data_2l0y_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 2l0y _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 114.754 1.39 . . . . 3.3199999999999998 114.754 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.1299999999999999 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 3.4100000000000001 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.3100000000000001 113.382 172.87 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.366 -0.605 . . . . 3.1899999999999999 109.366 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.28 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.2 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 16' ' ' SER . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 3.29 112.763 166.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 1.6599999999999999 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 14' ' ' MET . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.4299999999999999 110.799 -175.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.96999999999999997 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.4399999999999999 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.97999999999999998 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.60999999999999999 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.2200000000000002 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.91000000000000003 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 4.2199999999999998 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 2.1899999999999999 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.90000000000000002 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 1.6000000000000001 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 3.4199999999999999 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.8899999999999999 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.46999999999999997 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.422 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 3.6400000000000001 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.8999999999999999 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 4.1100000000000003 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.0600000000000001 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 2.5699999999999998 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.8999999999999999 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 2.3999999999999999 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.422 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 2.54 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 1.1599999999999999 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 2.1200000000000001 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.73999999999999999 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 2.9300000000000002 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.1499999999999999 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.68999999999999995 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 2.8599999999999999 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.7999999999999998 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 1.72 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 3.3199999999999998 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.0300000000000002 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.0700000000000001 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt . . . . . 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.8999999999999999 111.262 -170.753 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 CA--C 1.55 0.966 0 N-CA-C 113.127 0.788 . . . . 4.7599999999999998 113.127 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 3.2799999999999998 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.8199999999999998 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 2.4500000000000002 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.8700000000000001 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 5.1900000000000004 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9000000000000004 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 2.0 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 3.7200000000000002 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 7.1699999999999999 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 1.79 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 4.0300000000000002 111.485 171.236 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 N--CA 1.45 -0.441 0 CA-C-O 121.669 0.747 . . . . 3.6499999999999999 112.615 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.4399999999999999 112.491 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 2.6099999999999999 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.8199999999999998 111.269 168.522 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 118.787 -0.625 . . . . 2.4500000000000002 111.76 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.3 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 3.1400000000000001 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 1.55 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.90000000000000002 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 1.24 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.60999999999999999 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.55000000000000004 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.9399999999999999 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.90000000000000002 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 3.8900000000000001 113.209 171.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 1.54 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 1.6000000000000001 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 1.6799999999999999 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 4.1699999999999999 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.3199999999999998 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.47999999999999998 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 3.3900000000000001 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 3.7400000000000002 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 3.6200000000000001 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.83999999999999997 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 2.0899999999999999 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.0600000000000001 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.6800000000000002 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 2.5499999999999998 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.96 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.22 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.6599999999999999 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.1800000000000002 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.60999999999999999 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 2.8999999999999999 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78000000000000003 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 3.5 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 5.3700000000000001 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 1.5700000000000001 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 3.7999999999999998 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 3.8500000000000001 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.1200000000000001 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 3.0499999999999998 112.438 -172.071 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . 0.49 ' H ' ' CD2' ' B' ' 66' ' ' LEU 0.252 0.6 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 4.0300000000000002 115.315 . . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 4.71 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.5499999999999998 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.8999999999999999 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.9199999999999999 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 6.6299999999999999 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.3600000000000003 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 2.8300000000000001 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.6699999999999999 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 8.9900000000000002 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 2.3300000000000001 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 4.3899999999999997 112.441 173.701 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 122.195 0.998 . . . . 4.4100000000000001 112.862 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.4900000000000002 114.481 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.3999999999999999 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.621 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.5600000000000001 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 . . . . . 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.8799999999999999 114.212 174.384 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.934 1.087 . . . . 2.5600000000000001 113.934 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.6100000000000001 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 3.6200000000000001 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 1.73 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.76 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 1.1200000000000001 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.72 116.811 175.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.68000000000000005 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.54000000000000004 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.1100000000000003 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.85999999999999999 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 2.7000000000000002 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.621 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 1.76 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 1.26 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 1.6000000000000001 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 3.6499999999999999 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.8799999999999999 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51000000000000001 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 3.71 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 6.2999999999999998 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 3.8399999999999999 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.97999999999999998 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 2.5499999999999998 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.4400000000000004 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 2.3300000000000001 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 3.3199999999999998 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 1.1399999999999999 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 2.1299999999999999 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.6299999999999999 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.69999999999999996 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 3.0499999999999998 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.73999999999999999 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 2.8700000000000001 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 5.4299999999999997 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 1.75 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 5.1399999999999997 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.4700000000000002 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.90000000000000002 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm . . . . . 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 5.2300000000000004 111.304 -169.775 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 3.46 113.856 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.9900000000000002 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.0800000000000001 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 2.21 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 2.1899999999999999 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 6.2699999999999996 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.6600000000000001 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.98 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 4.7400000000000002 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 6.6799999999999997 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.75 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.9400000000000004 111.537 171.174 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.6699999999999999 120.387 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 3.02 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 t30 . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 4.9299999999999997 110.817 -176.001 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 109.552 -0.536 . . . . 3.27 109.552 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 2.1800000000000002 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.99 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 3.4900000000000002 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 1.8700000000000001 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.6499999999999999 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 2.5 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.80000000000000004 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 1.1499999999999999 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.1400000000000001 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.90000000000000002 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 3.8900000000000001 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 2.02 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.91000000000000003 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 1.6899999999999999 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 3.3799999999999999 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.8899999999999999 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56000000000000005 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 3.3199999999999998 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 6.29 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 4.6900000000000004 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.97999999999999998 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 2.3799999999999999 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.2400000000000002 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 3.4100000000000001 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 2.8799999999999999 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.78 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 2.0800000000000001 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.0699999999999998 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52000000000000002 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 2.8300000000000001 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.0699999999999998 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.57999999999999996 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 2.9500000000000002 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 8.6400000000000006 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 1.76 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 5.0599999999999996 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.8799999999999999 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.3300000000000001 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp . . . . . 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 5.0099999999999998 111.403 -170.872 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 3.6099999999999999 114.001 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 3.8900000000000001 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2000000000000002 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 2.2200000000000002 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 2.5099999999999998 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 4.7199999999999998 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 2.2799999999999998 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 3.1499999999999999 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 8.8800000000000008 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.8999999999999999 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 3.9399999999999999 112.756 169.465 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 112.726 0.639 . . . . 4.9000000000000004 112.726 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 3.2400000000000002 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.7200000000000002 113.549 176.266 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 120.607 0.241 . . . . 2.8999999999999999 110.397 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.47 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 3.0800000000000001 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 1.52 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.21 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.93000000000000005 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.26 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.63 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.59999999999999998 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.6600000000000001 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.90000000000000002 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 2.6299999999999999 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 1.5900000000000001 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.92000000000000004 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 1.5900000000000001 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 3.3999999999999999 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 2.9700000000000002 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51000000000000001 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 3.7000000000000002 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 3.7599999999999998 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 4.0300000000000002 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 1.1200000000000001 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 2.04 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.9300000000000002 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.8500000000000001 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 2.3399999999999999 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 2.77 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 1.1599999999999999 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.5800000000000001 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7000000000000002 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.77000000000000002 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 2.98 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.1400000000000001 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 1.1699999999999999 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 3.6099999999999999 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 5.8600000000000003 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 1.8 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 4.46 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 5.0300000000000002 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.4100000000000001 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.71999999999999997 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt . . . . . 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 3.4900000000000002 111.781 -170.396 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 4.1399999999999997 113.685 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 3.0800000000000001 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.9900000000000002 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 2.1299999999999999 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.96 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 4.54 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.6800000000000002 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.6899999999999999 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 3.7000000000000002 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 6.3700000000000001 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.9099999999999999 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 4.5199999999999996 111.161 173.627 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.576 0.954 . . . . 3.8199999999999998 113.576 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.9900000000000002 110.213 156.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.3599999999999999 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.3100000000000001 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.8900000000000001 115.571 -168.706 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.42 ' H ' HD11 ' A' ' 11' ' ' LEU . 2.8 mp . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 118.985 -0.531 . . . . 2.48 111.286 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.52 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 3.0699999999999998 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 1.72 114.073 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.3200000000000001 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 1.01 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.6000000000000001 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.56999999999999995 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.57999999999999996 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 1.0700000000000001 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 2.71 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 1.52 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.89000000000000001 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 1.71 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 4.2599999999999998 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 2.9900000000000002 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.45000000000000001 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 3.7599999999999998 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 5.3300000000000001 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 3.6800000000000002 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 1.1000000000000001 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.95 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 2.7200000000000002 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 2.8100000000000001 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 1.1899999999999999 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 2.1400000000000001 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.1499999999999999 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.47999999999999998 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 3.25 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.3599999999999999 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81000000000000005 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 2.9300000000000002 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 5.4699999999999998 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 1.77 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 3.7599999999999998 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 4.6100000000000003 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.3999999999999999 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68000000000000005 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 3.0 111.398 -167.903 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 113.746 1.017 . . . . 3.73 113.746 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 3.4399999999999999 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.9300000000000002 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 2.3199999999999998 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 2.1099999999999999 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 6.7699999999999996 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.2800000000000002 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 2.9199999999999999 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 3.25 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 7.2599999999999998 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 2.1499999999999999 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt . . . . . 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.8500000000000001 110.548 171.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 114.773 1.398 . . . . 3.7200000000000002 114.773 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.4399999999999999 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.537 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.0099999999999998 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 . . . . . 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.8500000000000001 114.275 170.173 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 113.605 0.965 . . . . 2.3100000000000001 113.605 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.5900000000000001 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 3.25 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 1.55 113.783 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.1299999999999999 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.4199999999999999 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.8600000000000001 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.58999999999999997 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.62 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 1.27 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 2.6400000000000001 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 1.54 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 1.1100000000000001 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 1.5600000000000001 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 3.27 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.8 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.42999999999999999 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 3.4900000000000002 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 4.8399999999999999 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 3.8999999999999999 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.82999999999999996 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.8799999999999999 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7000000000000002 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 3.6600000000000001 109.239 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 2.79 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 1.1699999999999999 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.53 114.949 172.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.6299999999999999 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.58999999999999997 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 3.6000000000000001 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.3300000000000001 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.84999999999999998 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 3.7000000000000002 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 4.6399999999999997 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 1.71 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.8599999999999999 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.79 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.7400000000000002 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79000000000000004 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt . . . . . 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 3.2000000000000002 112.403 -167.033 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 3.6600000000000001 113.311 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 3.0099999999999998 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.6800000000000002 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 2.1400000000000001 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.95 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 4.0999999999999996 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.4100000000000001 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.5099999999999998 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 3.8700000000000001 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 7.9199999999999999 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 1.9199999999999999 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 5.0300000000000002 111.754 167.443 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 114.267 1.21 . . . . 3.46 114.267 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.6800000000000002 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 4.1799999999999997 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.492 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.3400000000000001 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.4199999999999999 111.281 172.093 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 117.559 -1.21 . . . . 3.04 112.428 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.6499999999999999 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.6399999999999999 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 3.21 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 1.6200000000000001 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.8900000000000001 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 2.6200000000000001 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.6000000000000001 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.73 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.79000000000000004 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.8100000000000001 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.6800000000000002 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 2.8100000000000001 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.492 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 1.6899999999999999 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 1.1699999999999999 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 1.78 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 3.4500000000000002 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.97 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56000000000000005 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 3.4500000000000002 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 5.7599999999999998 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 3.9500000000000002 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.95999999999999996 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 2.7999999999999998 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.9399999999999999 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.9300000000000002 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 3.77 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.3700000000000001 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 2.3799999999999999 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.3599999999999999 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.80000000000000004 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 2.9399999999999999 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.2200000000000002 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.90000000000000002 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 3.9700000000000002 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 5.6799999999999997 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 1.73 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 3.77 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 3.73 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.6400000000000001 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92000000000000004 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 3.3100000000000001 111.332 -176.232 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 118.902 -0.571 . . . . 3.5699999999999998 112.218 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.452 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 3.1299999999999999 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.8200000000000003 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 2.8300000000000001 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.9299999999999999 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 5.5899999999999999 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.1100000000000003 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 2.4100000000000001 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 7.3499999999999996 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 6.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.97 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 4.0300000000000002 111.525 176.167 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 122.696 1.236 . . . . 2.8799999999999999 112.995 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.4399999999999999 110.374 165.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 3.1099999999999999 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.491 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.4299999999999999 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.6499999999999999 114.222 -171.813 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 110.232 -0.284 . . . . 3.5699999999999998 110.232 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.5600000000000001 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 3.6899999999999999 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 1.6299999999999999 113.709 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.3600000000000001 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 1.1899999999999999 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.5800000000000001 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65000000000000002 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.69999999999999996 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.8899999999999997 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 1.4299999999999999 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 3.1499999999999999 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.491 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 1.77 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.82999999999999996 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 1.53 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 3.27 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 2.6499999999999999 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.46999999999999997 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 3.3799999999999999 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 4.8700000000000001 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 4.1699999999999999 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.96999999999999997 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 2.3399999999999999 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.4900000000000002 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.3600000000000003 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.8799999999999999 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 3.1299999999999999 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 1.1899999999999999 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.6499999999999999 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.60999999999999999 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 3.1299999999999999 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.9199999999999999 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.79000000000000004 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 2.9399999999999999 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 4.29 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 1.5600000000000001 113.604 172.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 3.1400000000000001 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 4.4500000000000002 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.6899999999999999 115.592 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.68999999999999995 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 3.0800000000000001 111.014 -167.312 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.311 2.5 pt? . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 3.71 114.413 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 3.3300000000000001 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.6100000000000003 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 2.75 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.8700000000000001 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 4.2699999999999996 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.9500000000000002 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 3.1000000000000001 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.8799999999999999 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 8.1400000000000006 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 2.4900000000000002 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 4.5999999999999996 110.145 168.554 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 114.041 1.126 . . . . 3.4300000000000002 114.041 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.1200000000000001 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.552 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.8700000000000001 113.588 -170.202 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 2.5699999999999998 112.365 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.0900000000000001 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.3400000000000001 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 3.2599999999999998 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 1.76 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.1899999999999999 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 1.02 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 2.0699999999999998 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.82999999999999996 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.77000000000000002 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.1099999999999999 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.84999999999999998 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 2.71 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 1.3899999999999999 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.98999999999999999 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 1.5900000000000001 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 3.29 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 2.54 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.40000000000000002 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 3.6400000000000001 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 3.7400000000000002 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 4.1799999999999997 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.72999999999999998 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 2.2799999999999998 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.0099999999999998 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 2.8199999999999998 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 2.8999999999999999 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 2.29 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.5800000000000001 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.53000000000000003 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 2.9399999999999999 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.4700000000000002 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.96999999999999997 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 2.9500000000000002 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 6.2800000000000002 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 1.5700000000000001 113.626 171.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 3.1600000000000001 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.5599999999999996 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79000000000000004 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp . . . . . 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 4.79 110.722 -167.767 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 3.7599999999999998 114.943 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 2.8300000000000001 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.5299999999999998 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 2.4300000000000002 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 2.0899999999999999 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 5.9900000000000002 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.7300000000000004 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.5800000000000001 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 4.3600000000000003 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 9.0199999999999996 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 2.21 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 4.6799999999999997 111.172 171.648 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 113.274 0.842 . . . . 5.3200000000000003 113.274 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.5299999999999998 111.937 172.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.0099999999999998 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 118.018 -0.991 . . . . 2.9500000000000002 113.406 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.4099999999999999 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 5.0199999999999996 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 2.1899999999999999 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.8600000000000001 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.1599999999999999 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.96 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.0900000000000001 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.49 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.1200000000000001 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.1899999999999999 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 2.9399999999999999 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 1.9299999999999999 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 1.22 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 1.51 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 3.3599999999999999 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 2.0099999999999998 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.57999999999999996 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 3.54 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 3.5600000000000001 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 4.3499999999999996 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 2.29 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.7799999999999998 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.6099999999999999 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 2.6499999999999999 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 2.73 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.3 115.808 177.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.4099999999999999 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.3700000000000001 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.54000000000000004 114.561 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 3.0499999999999998 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.2400000000000002 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.68999999999999995 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 3.0899999999999999 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 6.4500000000000002 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 1.9399999999999999 113.351 167.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 4.3899999999999997 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 4.6299999999999999 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.90000000000000002 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp . . . . . 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 6.0800000000000001 111.269 -170.607 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 4.6699999999999999 114.281 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 5.0499999999999998 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.3600000000000003 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 3.02 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 4.5300000000000002 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.9000000000000004 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.7200000000000002 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 3.1099999999999999 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 4.5 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 8.0999999999999996 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 2.2999999999999998 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 5.0999999999999996 110.771 171.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.2599999999999998 114.46 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.464 HG23 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.5499999999999998 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 4.2599999999999998 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.555 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.6899999999999999 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.8799999999999999 113.567 174.745 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.544 0.572 . . . . 2.3900000000000001 112.544 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 3.54 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 1.6200000000000001 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.3400000000000001 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 1.0600000000000001 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.74 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.77000000000000002 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.88 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.0899999999999999 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.3600000000000001 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 2.9500000000000002 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 1.75 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 1.3100000000000001 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 1.5900000000000001 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 4.2000000000000002 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 2.7200000000000002 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.45000000000000001 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 3.25 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 4.79 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 3.8100000000000001 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.69999999999999996 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 2.1699999999999999 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.8799999999999999 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1000000000000001 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 2.8300000000000001 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 2.3900000000000001 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.8500000000000001 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.9199999999999999 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.1800000000000002 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.85999999999999999 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 2.6299999999999999 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.8400000000000001 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.73999999999999999 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 3.4900000000000002 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 5.1299999999999999 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 1.6899999999999999 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 3.52 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 4.2800000000000002 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.6699999999999999 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.96999999999999997 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt . . . . . 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.8900000000000001 111.832 -168.227 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 3.4199999999999999 115.009 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 3.79 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.0800000000000001 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 2.54 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.9199999999999999 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 5.6399999999999997 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.0199999999999996 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 3.3999999999999999 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 5.1299999999999999 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 7.71 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.76 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 5.3099999999999996 111.756 170.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 . . . . . 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.5600000000000001 116.694 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.409 HG23 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.3199999999999998 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.502 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.1400000000000001 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.3100000000000001 113.426 -176.056 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 114.301 1.223 . . . . 3.0800000000000001 114.301 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.6000000000000001 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.6399999999999999 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 3.0699999999999998 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 1.76 115.095 -167.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.9099999999999999 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.98999999999999999 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 1.3 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56999999999999995 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.63 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.8199999999999998 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.81000000000000005 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 2.8599999999999999 112.854 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.502 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 1.8500000000000001 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.93999999999999995 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 1.6499999999999999 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 3.3399999999999999 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 3.2400000000000002 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.41999999999999998 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.428 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 4.0700000000000003 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.8300000000000001 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 3.75 113.339 162.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.69999999999999996 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 2.0600000000000001 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.2599999999999998 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.7599999999999998 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 4.8300000000000001 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 3.9700000000000002 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.97 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.6600000000000001 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.4700000000000002 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.57999999999999996 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 2.52 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.8999999999999999 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76000000000000001 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 3.2400000000000002 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 4.3499999999999996 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 1.6899999999999999 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 3.2400000000000002 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.6600000000000001 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.5499999999999998 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66000000000000003 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 3.1499999999999999 111.933 -168.503 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 118.174 -0.917 . . . . 3.6299999999999999 110.872 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 4.1200000000000001 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.1399999999999997 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 2.1600000000000001 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.8 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 5.4299999999999997 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.9400000000000004 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.52 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 4.4699999999999998 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 9.1500000000000004 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 2.0299999999999998 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 4.2599999999999998 110.621 174.969 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 116.396 1.999 . . . . 4.8799999999999999 116.396 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.5600000000000001 111.815 170.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.73 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.3500000000000001 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 113.301 175.743 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 109.905 -0.406 . . . . 3.1400000000000001 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.73 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.4099999999999999 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 3.4100000000000001 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.75 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.48 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.27 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 2.2400000000000002 115.635 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.1599999999999999 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 1.1699999999999999 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.6800000000000002 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.53 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 2.6200000000000001 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 1.5600000000000001 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.93999999999999995 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 1.74 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 3.5 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.8899999999999999 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.47999999999999998 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 5.0099999999999998 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 5.0099999999999998 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 4.1100000000000003 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.85999999999999999 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 2.1600000000000001 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.8300000000000001 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 3.7799999999999998 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 3.4300000000000002 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.77 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.6200000000000001 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.58999999999999997 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 2.6800000000000002 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.0800000000000001 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67000000000000004 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 2.96 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 4.1600000000000001 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 1.72 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 3.48 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 4.04 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.9100000000000001 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm . . . . . 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 5.5999999999999996 111.839 -169.634 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 5.4500000000000002 115.285 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 3.5600000000000001 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.2599999999999998 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 2.3100000000000001 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 2.2999999999999998 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 5.3499999999999996 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.3700000000000001 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 2.9300000000000002 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 4.1799999999999997 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 6.6600000000000001 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 2.0099999999999998 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 4.9199999999999999 110.85 174.824 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 122.324 1.059 . . . . 3.2599999999999998 112.284 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.5499999999999998 111.105 177.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 4.04 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.5899999999999999 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 . . . . . 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.5099999999999998 115.389 -151.325 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 mp . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.06 1.133 . . . . 2.75 114.06 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.46 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.8999999999999999 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 3.6699999999999999 114.782 -175.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.8899999999999999 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.8200000000000001 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.5 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 2.0600000000000001 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 1.02 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.73999999999999999 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 3.23 112.357 168.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 1.8300000000000001 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.93999999999999995 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 1.6299999999999999 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 3.4399999999999999 113.151 -178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 2.8700000000000001 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51000000000000001 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 3.7999999999999998 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 3.6499999999999999 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 3.8599999999999999 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.98999999999999999 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 2.3199999999999998 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.9500000000000002 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.0800000000000001 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 2.7000000000000002 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 2.5499999999999998 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 2.0 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.8500000000000001 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.1099999999999999 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.54000000000000004 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 2.6000000000000001 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.3300000000000001 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.68999999999999995 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 3.04 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 5.2699999999999996 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 2.02 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 4.5599999999999996 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 4.8200000000000003 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.5099999999999998 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 2.7799999999999998 111.923 -169.967 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.968 1.099 . . . . 4.3300000000000001 113.968 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 4.3799999999999999 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.3200000000000003 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 2.52 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 4.25 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.96 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.0300000000000002 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.7599999999999998 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 4.4699999999999998 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 10.390000000000001 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 2.71 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt . . . . . 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 4.71 111.563 176.354 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 122.219 1.009 . . . . 3.1000000000000001 113.502 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.7799999999999998 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.555 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.3400000000000001 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.4500000000000002 112.442 168.72 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 118.657 -0.687 . . . . 2.3900000000000001 112.341 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.1599999999999999 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.4099999999999999 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.44 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.9100000000000001 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 1.79 113.445 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.0800000000000001 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.97999999999999998 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.4099999999999999 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55000000000000004 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.93000000000000005 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.8300000000000001 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 1.04 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.44 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 2.7000000000000002 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 1.6200000000000001 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 2.23 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 1.6100000000000001 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 3.3999999999999999 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.8899999999999999 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.40999999999999998 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 4.1299999999999999 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 3.5800000000000001 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 3.4500000000000002 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.76000000000000001 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 2.1299999999999999 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.5299999999999998 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.9399999999999999 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 3.2000000000000002 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 2.79 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.6499999999999999 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 2.0 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.7599999999999998 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.79000000000000004 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 2.3100000000000001 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.8200000000000001 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.71999999999999997 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 2.8799999999999999 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 4.6100000000000003 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 1.77 112.231 172.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 3.5299999999999998 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.7300000000000004 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.70999999999999996 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.9500000000000002 112.229 -168.24 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.229 -0.891 . . . . 3.3900000000000001 113.361 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 3.3599999999999999 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.6400000000000001 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 2.52 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 2.04 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 5.3300000000000001 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.5600000000000001 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 2.1200000000000001 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 3.4100000000000001 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 6.1600000000000001 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 1.8899999999999999 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 4.0800000000000001 111.892 177.213 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.007 1.114 . . . . 2.9700000000000002 114.007 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.9500000000000002 112.803 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.5499999999999998 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.477 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.5099999999999998 113.008 167.677 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 110.553 -0.166 . . . . 3.5099999999999998 110.553 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.6299999999999999 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 2.8100000000000001 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 1.6599999999999999 114.814 -172.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.9199999999999999 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 1.0800000000000001 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.8999999999999999 114.525 166.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81000000000000005 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.88 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.8099999999999996 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 1.1299999999999999 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 3.0699999999999998 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 1.49 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.95999999999999996 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 1.5900000000000001 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 3.25 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.9299999999999999 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.40999999999999998 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 4.0700000000000003 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 3.6299999999999999 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 3.6400000000000001 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.94999999999999996 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 2.1699999999999999 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.6200000000000001 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.8500000000000001 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 3.04 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 3.23 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.8 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.76 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.9700000000000002 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.73999999999999999 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 3.3999999999999999 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.1200000000000001 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 2.9500000000000002 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 6.5999999999999996 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 1.6399999999999999 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 3.27 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.6200000000000001 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.0600000000000001 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.68999999999999995 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.73 112.078 -168.864 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 113.272 0.841 . . . . 4.0099999999999998 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 2.8100000000000001 114.833 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 2.02 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.8600000000000001 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 6.1399999999999997 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.4699999999999998 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 2.1499999999999999 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 4.1799999999999997 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 6.8200000000000003 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.77 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 5.0 112.13 174.072 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 CA--C 1.542 0.665 0 N-CA-C 113.447 0.906 . . . . 3.75 113.447 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.0099999999999998 110.334 162.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.3700000000000001 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.524 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.3100000000000001 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.29 110.183 -174.204 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.666 -0.124 . . . . 2.98 110.666 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.3200000000000001 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.4099999999999999 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 2.5899999999999999 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 1.76 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 1.0700000000000001 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 2.0600000000000001 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.70999999999999996 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.56000000000000005 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.0300000000000002 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.80000000000000004 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 3.8399999999999999 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.524 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 2.0299999999999998 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.81000000000000005 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 1.5600000000000001 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 3.4900000000000002 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.8200000000000001 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53000000000000003 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 3.71 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 3.52 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 3.4100000000000001 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.1599999999999999 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 2.3100000000000001 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.1400000000000001 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.3199999999999998 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 3.3399999999999999 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 2.8399999999999999 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.8100000000000001 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.8999999999999999 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2000000000000002 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.64000000000000001 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 3.1600000000000001 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.5699999999999998 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.81999999999999995 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 3.5600000000000001 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 4.2199999999999998 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 1.52 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 3.46 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 4.0899999999999999 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.4300000000000002 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64000000000000001 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp . . . . . 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 4.4400000000000004 111.655 -170.015 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 4.2999999999999998 114.209 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 3.3599999999999999 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.9199999999999999 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 2.25 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.96 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 4.0899999999999999 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.7599999999999998 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 2.4100000000000001 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 3.3599999999999999 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 5.6100000000000003 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 1.8799999999999999 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.9100000000000001 110.439 167.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 . . . . . 0 CA--C 1.551 0.999 0 N-CA-C 113.395 0.887 . . . . 3.6600000000000001 113.395 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.9100000000000001 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.601 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.8300000000000001 115.113 -169.331 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 118.403 -0.808 . . . . 2.1600000000000001 111.782 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.71 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6000000000000001 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 3.3900000000000001 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 1.73 113.884 -166.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.54 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.94999999999999996 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 1.3899999999999999 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81000000000000005 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.55000000000000004 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.2799999999999998 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.1200000000000001 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 3.8100000000000001 112.662 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 1.8899999999999999 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 1.3400000000000001 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 1.6399999999999999 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 3.3999999999999999 112.632 -176.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 2.0299999999999998 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.59999999999999998 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 3.7400000000000002 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 3.4399999999999999 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 4.1500000000000004 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 1.3500000000000001 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 2.1499999999999999 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6000000000000001 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.9500000000000002 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 2.9700000000000002 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 2.6899999999999999 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.8700000000000001 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 2.1000000000000001 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.9199999999999999 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.69999999999999996 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 3.8500000000000001 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.7799999999999998 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.4199999999999999 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 3.8799999999999999 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 5.6500000000000004 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 1.79 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 3.5800000000000001 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 4.0300000000000002 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.3500000000000001 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.96999999999999997 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt . . . . . 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.8399999999999999 112.224 -171.102 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 114.853 1.427 . . . . 3.7999999999999998 114.853 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 3.6400000000000001 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 2.4100000000000001 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.8100000000000001 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 5.7599999999999998 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 2.3300000000000001 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 3.5499999999999998 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 6.4400000000000004 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 2.2799999999999998 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 5.9699999999999998 111.729 179.353 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 115.743 1.757 . . . . 2.8399999999999999 115.743 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.8500000000000001 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.3599999999999999 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TRP . . . . . 0.496 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 4.0999999999999996 113.128 -163.778 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 CA--C 1.546 0.795 0 CA-C-O 119.511 -0.28 . . . . 2.9199999999999999 110.835 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.73 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.4199999999999999 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 3.3199999999999998 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 1.6399999999999999 113.369 172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.1299999999999999 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.93000000000000005 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.51 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.73999999999999999 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.57999999999999996 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.0800000000000001 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.82999999999999996 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 3.7400000000000002 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 1.74 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 1.27 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 1.5600000000000001 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 3.29 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 2.4399999999999999 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45000000000000001 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 3.7999999999999998 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 3.6400000000000001 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 3.9300000000000002 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 1.02 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 2.1699999999999999 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.4100000000000001 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.3300000000000001 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 2.6800000000000002 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 3.1299999999999999 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.46 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.51 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.1699999999999999 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.47999999999999998 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 3.5299999999999998 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.8999999999999999 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89000000000000001 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 2.9700000000000002 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.75 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 1.6799999999999999 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 3.5899999999999999 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 5.5999999999999996 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.7400000000000002 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.73999999999999999 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt . . . . . 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 3.1600000000000001 111.414 -169.635 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 5.1100000000000003 115.496 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 4.1699999999999999 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.8399999999999999 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 2.0499999999999998 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.8200000000000001 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 5.6699999999999999 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.4800000000000004 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 2.1299999999999999 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 4.75 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 7.0099999999999998 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 2.04 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 4.7000000000000002 111.282 171.915 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.917 -0.563 . . . . 5.4500000000000002 111.768 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.08 24.07 30.57 Favored Glycine 0 CA--C 1.538 1.52 0 C-N-CA 124.335 0.969 . . . . 2.6299999999999999 114.494 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.33 165.79 23.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.821 2.048 . . . . 3.3199999999999998 114.754 -173.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.1299999999999999 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 3.4100000000000001 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -74.37 -14.23 60.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.3100000000000001 113.382 172.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.4 m -54.08 127.27 54.5 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 125.297 1.439 . . . . 5.5499999999999998 112.514 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -58.06 139.13 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.94 2.426 . . . . 5.04 114.782 -172.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m 65.49 -33.58 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.922 2.489 . . . . 5.8200000000000003 115.901 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt -60.83 -46.2 91.5 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.355 1.434 . . . . 3.1899999999999999 109.366 159.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.28 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.2 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.402 ' C ' ' H ' ' A' ' 16' ' ' SER . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 3.29 112.763 166.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 1.6599999999999999 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 14' ' ' MET . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.4299999999999999 110.799 -175.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.96999999999999997 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.4399999999999999 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.97999999999999998 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.60999999999999999 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.2200000000000002 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.91000000000000003 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 4.2199999999999998 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 2.1899999999999999 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.90000000000000002 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 1.6000000000000001 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 3.4199999999999999 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.8899999999999999 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.46999999999999997 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.422 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 3.6400000000000001 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.8999999999999999 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 4.1100000000000003 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.0600000000000001 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 2.5699999999999998 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.8999999999999999 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 2.3999999999999999 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.422 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 2.54 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 1.1599999999999999 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 2.1200000000000001 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.73999999999999999 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 2.9300000000000002 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.1499999999999999 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.68999999999999995 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 2.8599999999999999 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.7999999999999998 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 1.72 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 3.3199999999999998 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.0300000000000002 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.0700000000000001 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt -80.91 -20.0 43.1 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.8999999999999999 111.262 -170.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -66.09 -19.85 65.98 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.903 1.681 . . . . 2.1899999999999999 112.487 172.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -79.53 -27.08 41.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.861 1.265 . . . . 4.0700000000000003 113.853 168.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -132.83 102.65 13.44 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 123.499 0.719 . . . . 3.98 112.87 -164.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.18 -50.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.447 2.098 . . . . 2.6600000000000001 112.444 -173.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -159.23 54.67 0.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 123.92 1.819 . . . . 4.71 111.439 -169.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.24 -10.17 14.97 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 128.413 2.685 . . . . 2.5299999999999998 111.996 -155.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 15.6 p90 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.232 2.613 . . . . 4.0700000000000003 111.945 -165.36 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 112.151 0.426 . . . . 12.220000000000001 112.151 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -68.09 166.78 15.34 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.526 1.53 . . . . 10.74 112.713 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.2 t -95.69 127.67 41.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 5.4299999999999997 111.546 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.33 72.76 0.98 Allowed Glycine 0 CA--C 1.534 1.26 0 N-CA-C 115.698 1.039 . . . . 4.7300000000000004 115.698 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -76.5 -16.5 59.63 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.617 1.34 . . . . 8.7599999999999998 114.617 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt -109.09 -0.99 19.15 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.126 1.77 . . . . 4.7599999999999998 113.127 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 3.2799999999999998 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.8199999999999998 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 2.4500000000000002 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.8700000000000001 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 5.1900000000000004 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9000000000000004 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 2.0 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 3.7200000000000002 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 7.1699999999999999 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 1.79 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.5 -36.55 79.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 4.0300000000000002 111.485 171.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.41 -32.71 61.04 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.707 1.622 . . . . 1.75 114.041 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -84.86 -37.43 20.68 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.732 1.266 . . . . 6.7599999999999998 113.484 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -80.54 -33.61 36.12 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.915 1.45 . . . . 4.3099999999999996 114.915 -169.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.94 1.296 . . . . 5.7999999999999998 111.25 -178.124 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 118.565 -0.731 . . . . 3.9199999999999999 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.48 27.69 70.89 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-N 119.87 1.214 . . . . 2.77 113.401 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -72.58 162.01 30.03 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.563 2.345 . . . . 3.6499999999999999 112.615 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.4399999999999999 112.491 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 2.6099999999999999 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -57.51 142.69 43.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.8199999999999998 111.269 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.5 m 58.68 160.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 127.101 2.161 . . . . 5.5 114.964 -175.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -75.2 22.38 0.43 Allowed 'Trans proline' 0 CA--C 1.547 1.134 0 N-CA-C 118.73 2.55 . . . . 5.7599999999999998 118.73 -154.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.15 -60.31 2.3 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.751 1.16 . . . . 4.3399999999999999 112.868 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mp -110.24 -13.63 14.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.298 1.039 . . . . 2.4500000000000002 111.76 166.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.3 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 3.1400000000000001 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 1.55 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.90000000000000002 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 1.24 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.60999999999999999 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.55000000000000004 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.9399999999999999 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.90000000000000002 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 3.8900000000000001 113.209 171.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 1.54 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 1.6000000000000001 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 1.6799999999999999 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 4.1699999999999999 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.3199999999999998 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.47999999999999998 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 3.3900000000000001 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 3.7400000000000002 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 3.6200000000000001 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.83999999999999997 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 2.0899999999999999 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.0600000000000001 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.6800000000000002 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 2.5499999999999998 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.96 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.22 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.6599999999999999 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.1800000000000002 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.60999999999999999 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 2.8999999999999999 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78000000000000003 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 3.5 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 5.3700000000000001 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 1.5700000000000001 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 3.7999999999999998 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 3.8500000000000001 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.1200000000000001 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.87 -8.82 58.63 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 3.0499999999999998 112.438 -172.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -71.46 -23.75 61.89 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.938 1.695 . . . . 2.23 112.751 163.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -70.93 -48.65 52.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.13 0.972 . . . . 4.3399999999999999 110.98 169.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.28 95.68 35.59 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 125.993 1.717 . . . . 3.6699999999999999 109.334 -168.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -76.53 -35.29 2.18 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 124.026 3.15 . . . . 4.0599999999999996 115.06 -161.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -149.62 -2.52 0.42 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.578 1.151 . . . . 6.0599999999999996 113.194 -166.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.73 12.09 9.67 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 115.208 1.559 . . . . 3.9399999999999999 115.208 -142.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.428 0 C-N-CA 127.487 2.315 . . . . 4.3799999999999999 114.595 -157.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.949 -0.389 . . . . 11.67 109.949 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -67.96 161.94 25.45 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.522 0.564 . . . . 11.300000000000001 112.522 -178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 66.09 -39.06 0.31 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.936 2.094 . . . . 4.7400000000000002 114.407 -175.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.68 14.99 0.68 Allowed Glycine 0 CA--C 1.535 1.31 0 N-CA-C 118.632 2.213 . . . . 5.1900000000000004 118.632 -167.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -50.54 -30.92 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 121.232 2.516 . . . . 7.7199999999999998 114.99 178.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . 0.49 ' H ' ' CD2' ' B' ' 66' ' ' LEU 0.252 0.6 OUTLIER -79.93 -19.9 46.94 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 4.0300000000000002 115.315 176.489 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 4.71 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.5499999999999998 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.8999999999999999 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.9199999999999999 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 6.6299999999999999 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.3600000000000003 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 2.8300000000000001 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.6699999999999999 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 8.9900000000000002 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 2.3300000000000001 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt -63.47 -39.35 94.24 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 4.3899999999999997 112.441 173.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 -44.42 88.43 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.076 0.846 . . . . 2.1800000000000002 112.803 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -72.14 -27.47 62.63 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.53 0.937 . . . . 7.7000000000000002 113.53 171.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -68.58 -50.52 51.08 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.966 1.307 . . . . 4.6200000000000001 112.79 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 C--O 1.254 1.33 0 C-N-CA 124.624 1.17 . . . . 5.54 112.653 -168.91 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 117.767 -1.111 . . . . 7.46 111.915 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.83 15.39 41.7 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 120.254 1.388 . . . . 6.3700000000000001 115.757 -173.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -76.97 162.54 27.49 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.756 1.278 . . . . 4.4100000000000001 112.862 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.4900000000000002 114.481 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.3999999999999999 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.621 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.5600000000000001 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.32 -20.24 64.73 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.8799999999999999 114.212 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 91.4 p -66.31 146.67 99.05 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 121.316 -0.865 . . . . 5.4500000000000002 111.628 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -62.88 -8.93 14.84 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.242 2.628 . . . . 5.5 113.135 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.3 m -58.59 -51.93 67.81 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.748 2.019 . . . . 5.1399999999999997 112.432 171.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.87 -15.14 13.42 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.298 1.439 . . . . 2.5600000000000001 113.934 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.6100000000000001 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 3.6200000000000001 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 1.73 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.76 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 1.1200000000000001 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.72 116.811 175.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.68000000000000005 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.54000000000000004 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.1100000000000003 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.85999999999999999 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 2.7000000000000002 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.621 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 1.76 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 1.26 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 1.6000000000000001 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 3.6499999999999999 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.8799999999999999 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51000000000000001 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 3.71 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 6.2999999999999998 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 3.8399999999999999 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.97999999999999998 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 2.5499999999999998 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.4400000000000004 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 2.3300000000000001 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 3.3199999999999998 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 1.1399999999999999 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 2.1299999999999999 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.6299999999999999 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.69999999999999996 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 3.0499999999999998 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.73999999999999999 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 2.8700000000000001 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 5.4299999999999997 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 1.75 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 5.1399999999999997 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.4700000000000002 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.90000000000000002 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm -73.17 -21.16 60.75 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 5.2300000000000004 111.304 -169.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -56.49 -18.83 12.75 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.312 1.445 . . . . 2.25 113.733 165.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -62.78 -34.83 78.06 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.759 1.623 . . . . 4.2300000000000004 113.86 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -144.29 127.82 8.84 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.189 0.996 . . . . 4.21 111.238 -167.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -81.24 -45.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 121.552 1.501 . . . . 2.6899999999999999 115.245 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -160.16 64.99 0.34 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 122.992 1.377 . . . . 4.3300000000000001 110.848 -161.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.282 0.4 OUTLIER -135.9 -14.01 1.87 Allowed 'General case' 0 CA--C 1.561 1.369 0 CA-C-N 113.017 -1.901 . . . . 2.8500000000000001 112.012 -160.153 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.468 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 2.5 p90 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.033 1.733 . . . . 3.6000000000000001 115.235 -162.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' B' ' 62' ' ' HIS . 0.7 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 111.236 0.087 . . . . 17.5 111.236 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . 0.465 ' H ' ' CD ' ' B' ' 61' ' ' GLU . 79.5 m80 -83.5 -178.89 7.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.16 2.184 . . . . 14.24 113.277 -177.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.59 155.14 12.92 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.949 -1.094 . . . . 8.3499999999999996 111.853 165.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.44 -50.6 4.08 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.507 1.051 . . . . 3.6299999999999999 111.189 -165.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -82.44 -40.66 20.87 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.537 0.94 . . . . 5.8499999999999996 113.537 176.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.43 -30.09 68.23 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 3.46 113.856 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.9900000000000002 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.0800000000000001 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 2.21 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 2.1899999999999999 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 6.2699999999999996 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.6600000000000001 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.98 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 4.7400000000000002 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 6.6799999999999997 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.75 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt -62.09 -48.91 78.06 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.9400000000000004 111.537 171.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.66 -30.99 69.99 Favored Glycine 0 CA--C 1.537 1.469 0 O-C-N 120.978 -1.077 . . . . 2.5 114.252 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -74.86 -34.23 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.967 2.107 . . . . 5.4299999999999997 113.188 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtt -68.5 -38.36 80.89 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 117.75 -1.119 . . . . 4.6299999999999999 112.799 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.489 1.499 0 C-N-CA 124.493 1.117 . . . . 5.6299999999999999 113.925 179.057 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 7.5 p30 . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.975 1.102 . . . . 6.8300000000000001 113.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.5 -32.65 6.96 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.806 1.193 . . . . 3.2599999999999998 113.142 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.09 -3.9 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.6699999999999999 120.387 153.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 3.02 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -103.35 165.98 10.71 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 4.9299999999999997 110.817 -176.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 32.5 t 68.77 147.08 0.11 Allowed Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.63 2.772 . . . . 5.8799999999999999 113.337 -166.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -68.55 19.15 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 124.031 3.154 . . . . 5.9800000000000004 117.075 -171.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 m -101.84 -101.17 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.026 1.331 . . . . 3.1499999999999999 109.773 -170.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt -57.85 -40.8 81.01 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.147 -0.971 . . . . 3.27 109.552 166.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 2.1800000000000002 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.99 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 3.4900000000000002 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 1.8700000000000001 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.6499999999999999 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 2.5 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.80000000000000004 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 1.1499999999999999 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.1400000000000001 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.90000000000000002 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 3.8900000000000001 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 2.02 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.91000000000000003 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 1.6899999999999999 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 3.3799999999999999 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.8899999999999999 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56000000000000005 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 3.3199999999999998 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 6.29 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 4.6900000000000004 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.97999999999999998 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 2.3799999999999999 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.2400000000000002 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 3.4100000000000001 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 2.8799999999999999 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.78 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 2.0800000000000001 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.0699999999999998 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52000000000000002 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 2.8300000000000001 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.0699999999999998 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.57999999999999996 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 2.9500000000000002 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 8.6400000000000006 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 1.76 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 5.0599999999999996 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.8799999999999999 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.3300000000000001 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp -83.72 -19.82 34.54 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 5.0099999999999998 111.403 -170.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -69.19 -5.22 21.22 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.18 1.392 . . . . 2.48 113.729 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -79.16 -29.89 43.25 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.278 1.214 . . . . 4.9400000000000004 114.278 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -121.66 130.6 24.7 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 118.794 0.725 . . . . 4.1200000000000001 112.838 -165.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -89.1 -28.04 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.942 2.428 . . . . 5.0700000000000003 113.564 171.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -161.69 -0.8 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.824 1.416 . . . . 7.7699999999999996 114.824 -156.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.28 -17.72 63.1 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.668 1.987 . . . . 4.29 112.975 -165.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.2 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 128.893 2.877 . . . . 4.9699999999999998 113.382 -167.132 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.91 -0.09 . . . . 11.119999999999999 110.872 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -110.66 148.19 32.75 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.654 1.182 . . . . 9.0500000000000007 112.288 172.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -11.86 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.119 1.367 . . . . 5.29 114.137 172.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.3 174.1 50.15 Favored Glycine 0 CA--C 1.534 1.265 0 O-C-N 121.224 -0.923 . . . . 5.1699999999999999 115.066 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -66.01 -37.96 87.24 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.152 1.381 . . . . 8.2799999999999994 113.49 -170.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -54.21 -42.86 70.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 3.6099999999999999 114.001 -168.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 3.8900000000000001 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2000000000000002 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 2.2200000000000002 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 2.5099999999999998 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 4.7199999999999998 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 2.2799999999999998 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 3.1499999999999999 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 8.8800000000000008 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.8999999999999999 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp -64.59 -30.9 71.93 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 3.9399999999999999 112.756 169.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.14 -43.26 98.53 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.598 1.57 . . . . 2.71 113.078 170.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -72.61 -42.29 64.64 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.527 -0.984 . . . . 6.5999999999999996 113.429 171.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -70.3 -40.41 74.27 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.98 1.312 . . . . 5.5199999999999996 113.751 -173.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 31.2 mm . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 116.92 -1.514 . . . . 5.0099999999999998 112.677 -168.312 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.0 t30 . . . . . 0 N--CA 1.477 0.918 0 CA-C-O 118.594 -0.717 . . . . 5.96 112.76 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.8 21.85 78.85 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 121.02 1.736 . . . . 3.9399999999999999 113.793 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -109.86 -34.02 6.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.394 1.878 . . . . 4.9000000000000004 112.726 -171.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 3.2400000000000002 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -65.92 -30.42 71.0 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.7200000000000002 113.549 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -63.91 128.69 93.23 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 124.685 1.194 . . . . 5.75 110.885 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.83 -18.82 18.87 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.515 2.143 . . . . 5.4400000000000004 116.433 -152.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -94.37 -51.78 4.64 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.666 1.121 . . . . 4.5199999999999996 111.487 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -60.71 -41.48 95.34 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.271 -0.893 . . . . 2.8999999999999999 110.397 171.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.47 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 3.0800000000000001 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 1.52 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.21 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.93000000000000005 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.26 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.63 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.59999999999999998 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.6600000000000001 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.90000000000000002 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 2.6299999999999999 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.493 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 1.5900000000000001 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.92000000000000004 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 1.5900000000000001 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 3.3999999999999999 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 2.9700000000000002 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51000000000000001 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 3.7000000000000002 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 3.7599999999999998 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 4.0300000000000002 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 1.1200000000000001 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 2.04 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.9300000000000002 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.8500000000000001 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 2.3399999999999999 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 2.77 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 1.1599999999999999 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.5800000000000001 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7000000000000002 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.77000000000000002 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 2.98 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.1400000000000001 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 1.1699999999999999 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 3.6099999999999999 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 5.8600000000000003 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 1.8 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 4.46 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 5.0300000000000002 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.4100000000000001 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.71999999999999997 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt -88.22 -15.78 35.0 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 3.4900000000000002 111.781 -170.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -60.13 -20.98 60.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.758 1.223 . . . . 1.5700000000000001 112.459 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -76.12 -33.43 59.44 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.525 1.13 . . . . 3.8100000000000001 113.283 168.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -135.1 108.62 10.51 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.794 1.035 . . . . 3.7200000000000002 113.794 -161.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.56 -50.98 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.686 2.257 . . . . 2.3199999999999998 113.609 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -159.62 62.55 0.37 Allowed 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 124.293 1.996 . . . . 4.7699999999999996 110.659 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.27 0.4 OUTLIER -106.34 -9.14 16.9 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 112.622 -2.081 . . . . 2.3900000000000001 111.719 -157.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 17.7 p90 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 128.141 2.576 . . . . 4.1699999999999999 111.984 -165.252 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.323 -0.621 . . . . 14.23 109.323 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 59.56 25.7 14.6 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.569 1.692 . . . . 11.27 115.569 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 t -98.98 144.83 27.69 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.095 1.358 . . . . 5.6299999999999999 110.576 167.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.25 134.42 52.41 Favored Glycine 0 CA--C 1.536 1.355 0 N-CA-C 115.247 0.859 . . . . 3.8199999999999998 115.247 -164.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.76 -15.71 13.42 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.085 1.354 . . . . 7.4400000000000004 114.171 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -59.66 -29.24 67.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 4.1399999999999997 113.685 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 3.0800000000000001 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.9900000000000002 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 2.1299999999999999 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.96 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 4.54 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.6800000000000002 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.6899999999999999 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 3.7000000000000002 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 6.3700000000000001 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.9099999999999999 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.11 -50.64 72.8 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 4.5199999999999996 111.161 173.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.38 -28.68 69.81 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-N 118.934 0.788 . . . . 1.99 114.202 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -79.65 -25.7 41.29 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.122 1.369 . . . . 5.3499999999999996 113.476 170.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -85.9 -59.12 2.39 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.748 1.619 . . . . 4.6399999999999997 113.788 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 9.1 pt . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 114.6 1.333 . . . . 6.2199999999999998 114.6 -160.83 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 118.456 -0.783 . . . . 6.4100000000000001 110.993 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.66 6.45 66.71 Favored Glycine 0 CA--C 1.541 1.711 0 N-CA-C 116.553 1.381 . . . . 4.7300000000000004 116.553 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -85.47 -179.95 7.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.844 1.658 . . . . 3.8199999999999998 113.576 -172.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.9900000000000002 110.213 156.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.3599999999999999 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.3100000000000001 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -130.5 -40.92 1.23 Allowed 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.8900000000000001 115.571 -168.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.9 m -81.19 -45.93 1.15 Allowed Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 119.916 1.235 . . . . 5.5599999999999996 114.265 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -81.38 173.61 11.42 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.724 2.282 . . . . 8.9900000000000002 112.631 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -77.09 19.04 0.33 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.984 1.846 . . . . 3.9199999999999999 115.984 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.42 ' H ' HD11 ' A' ' 11' ' ' LEU . 2.8 mp -78.42 -6.63 55.84 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.892 -1.13 . . . . 2.48 111.286 157.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.52 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 3.0699999999999998 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 1.72 114.073 -175.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.3200000000000001 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 1.01 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.6000000000000001 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.56999999999999995 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.57999999999999996 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 1.0700000000000001 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 2.71 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 1.52 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.89000000000000001 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 1.71 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 4.2599999999999998 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 2.9900000000000002 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.45000000000000001 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 3.7599999999999998 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 5.3300000000000001 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 3.6800000000000002 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 1.1000000000000001 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.95 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 2.7200000000000002 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 2.8100000000000001 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 1.1899999999999999 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 2.1400000000000001 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.1499999999999999 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.47999999999999998 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 3.25 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.3599999999999999 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81000000000000005 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 2.9300000000000002 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 5.4699999999999998 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 1.77 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 3.7599999999999998 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 4.6100000000000003 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.3999999999999999 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68000000000000005 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt -76.62 -19.67 57.56 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 3.0 111.398 -167.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -55.58 -26.8 45.61 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.692 1.597 . . . . 1.6899999999999999 113.328 170.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -61.0 -32.39 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.14 1.533 . . . . 4.7599999999999998 115.14 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -144.32 126.6 8.32 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.727 1.01 . . . . 3.48 113.727 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -94.37 -38.98 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 122.674 2.25 . . . . 2.3700000000000001 115.46 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -152.98 76.73 1.14 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.169 1.461 . . . . 4.46 109.913 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.261 0.2 OUTLIER -144.84 -8.4 0.63 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 113.463 -1.699 . . . . 2.6400000000000001 111.132 -163.219 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.775 2.43 . . . . 3.4700000000000002 113.584 -164.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.092 -0.336 . . . . 13.6 110.092 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.8 p80 -145.13 173.05 12.25 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.793 0.837 . . . . 9.0099999999999998 111.848 166.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 128.93 38.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.777 -0.577 . . . . 5.0099999999999998 109.584 175.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.63 173.39 37.47 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.562 1.077 . . . . 4.1399999999999997 115.384 -170.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -78.52 -5.9 53.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.263 1.425 . . . . 7.1200000000000001 113.824 -173.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -63.81 -34.75 78.61 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.337 1.055 . . . . 3.73 113.746 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 3.4399999999999999 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.9300000000000002 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 2.3199999999999998 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 2.1099999999999999 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 6.7699999999999996 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.2800000000000002 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 2.9199999999999999 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 3.25 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 7.2599999999999998 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 2.1499999999999999 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt -61.88 -43.26 99.21 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.8500000000000001 110.548 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.98 -43.83 92.96 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.546 0.612 . . . . 1.8700000000000001 113.563 172.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -67.99 -31.89 71.92 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.876 1.671 . . . . 5.3300000000000001 113.845 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -80.71 -49.38 11.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.494 1.518 . . . . 4.2400000000000002 113.327 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.7 mm . . . . . 0 C--O 1.253 1.288 0 C-N-CA 125.333 1.453 . . . . 5.9800000000000004 113.381 -165.818 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.996 -0.526 . . . . 5.4500000000000002 111.491 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.18 15.99 32.15 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.051 1.31 . . . . 3.2200000000000002 115.681 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -82.41 164.4 21.03 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.174 1.487 . . . . 3.7200000000000002 114.773 -165.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.4399999999999999 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.537 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.0099999999999998 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 53.1 -138.86 1.08 Allowed 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.8500000000000001 114.275 170.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.2 t -99.3 -58.78 0.13 Allowed Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 126.679 1.992 . . . . 8.4399999999999995 113.928 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -79.8 -179.83 5.65 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.92 2.413 . . . . 5.3399999999999999 111.857 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.5 m 58.25 -108.58 0.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.255 1.422 . . . . 3.6899999999999999 112.069 175.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -75.95 -11.88 60.04 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.382 0.992 . . . . 2.3100000000000001 113.605 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.5900000000000001 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 3.25 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 1.55 113.783 179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.1299999999999999 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.4199999999999999 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.8600000000000001 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.58999999999999997 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.62 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 1.27 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 2.6400000000000001 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 1.54 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 1.1100000000000001 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 1.5600000000000001 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 3.27 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.8 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.42999999999999999 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 3.4900000000000002 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 4.8399999999999999 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 3.8999999999999999 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.82999999999999996 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.8799999999999999 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7000000000000002 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 3.6600000000000001 109.239 177.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 2.79 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 1.1699999999999999 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.53 114.949 172.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.6299999999999999 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.58999999999999997 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 3.6000000000000001 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.3300000000000001 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.84999999999999998 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 3.7000000000000002 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 4.6399999999999997 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 1.71 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.8599999999999999 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.79 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.7400000000000002 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79000000000000004 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt -78.87 -19.39 52.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 3.2000000000000002 112.403 -167.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -62.37 -19.19 63.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.836 2.055 . . . . 1.8300000000000001 113.504 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -69.65 -51.3 36.05 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.172 1.389 . . . . 3.8300000000000001 112.299 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -113.13 122.58 35.38 Favored Pre-proline 0 N--CA 1.468 0.472 0 C-N-CA 123.374 0.67 . . . . 3.3100000000000001 111.526 -168.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -85.54 -26.11 1.42 Allowed 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.166 2.578 . . . . 2.3300000000000001 113.391 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.56 -0.05 0.11 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.075 1.139 . . . . 4.1200000000000001 114.075 -158.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -76.55 -8.94 58.21 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.616 1.966 . . . . 2.5699999999999998 111.445 -167.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.935 0 C-N-CA 131.143 3.777 . . . . 3.9300000000000002 111.436 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.586 0.232 . . . . 10.890000000000001 111.19 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -73.66 -25.96 60.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.015 1.726 . . . . 9.3300000000000001 114.152 -176.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.3 t -123.1 133.31 54.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.004 1.722 . . . . 4.54 111.965 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.4 -18.86 0.02 OUTLIER Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.554 1.382 . . . . 4.3399999999999999 116.554 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -57.23 -49.9 74.59 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.053 1.926 . . . . 6.6299999999999999 112.911 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.32 -29.41 66.12 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 3.6600000000000001 113.311 171.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 3.0099999999999998 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.6800000000000002 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 2.1400000000000001 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.95 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 4.0999999999999996 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.4100000000000001 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.5099999999999998 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 3.8700000000000001 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 7.9199999999999999 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 1.9199999999999999 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt -70.07 -44.29 69.4 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 5.0300000000000002 111.754 167.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.22 -27.68 60.59 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 119.735 1.152 . . . . 2.1600000000000001 114.326 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -76.63 -47.67 21.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.322 1.849 . . . . 5.4100000000000001 112.1 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -71.76 -29.45 64.51 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.733 1.613 . . . . 4.46 115.318 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 12.2 tt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 126.293 1.837 . . . . 5.8300000000000001 113.205 -174.618 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.0 t30 . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 119.642 -0.218 . . . . 4.25 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.47 -8.7 26.37 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 126.067 1.794 . . . . 2.6000000000000001 114.942 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -80.24 155.53 27.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.253 1.421 . . . . 3.46 114.267 -173.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.6800000000000002 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 4.1799999999999997 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.492 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.3400000000000001 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.48 143.19 46.49 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.4199999999999999 111.281 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t 62.61 150.57 0.1 Allowed Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 128.229 2.611 . . . . 6.4199999999999999 113.046 -163.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -62.91 -0.44 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.217 2.612 . . . . 7.2999999999999998 117.46 -169.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.4 m -53.65 -58.3 7.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.697 1.999 . . . . 4.5899999999999999 113.458 -169.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp -95.03 -17.48 21.87 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.234 1.414 . . . . 3.04 112.428 155.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.6499999999999999 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.6399999999999999 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 3.21 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 1.6200000000000001 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.8900000000000001 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 2.6200000000000001 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.6000000000000001 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.73 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.79000000000000004 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.8100000000000001 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.6800000000000002 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 2.8100000000000001 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.492 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 1.6899999999999999 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 1.1699999999999999 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 1.78 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 3.4500000000000002 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.97 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56000000000000005 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 3.4500000000000002 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 5.7599999999999998 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 3.9500000000000002 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.95999999999999996 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 2.7999999999999998 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.9399999999999999 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.9300000000000002 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 3.77 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.3700000000000001 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 2.3799999999999999 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.3599999999999999 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.80000000000000004 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 2.9399999999999999 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.2200000000000002 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.90000000000000002 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 3.9700000000000002 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 5.6799999999999997 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 1.73 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 3.77 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 3.73 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.6400000000000001 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92000000000000004 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.49 -25.84 35.67 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 3.3100000000000001 111.332 -176.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -62.84 -22.49 66.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.381 1.873 . . . . 2.0699999999999998 112.523 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -66.23 -34.12 77.29 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.974 1.31 . . . . 6.5899999999999999 112.843 170.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 20.3 m-30 -124.42 110.99 28.24 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.759 0.824 . . . . 3.5899999999999999 113.079 -160.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.54 -50.49 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.406 2.071 . . . . 2.5299999999999998 113.448 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -163.8 52.55 0.15 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.233 1.968 . . . . 4.5700000000000003 112.314 -171.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.265 0.2 OUTLIER -91.19 -42.06 10.64 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 112.098 -2.319 . . . . 3.0099999999999998 111.287 -163.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.328 1.451 . . . . 4.0999999999999996 112.443 -151.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 119.326 -0.369 . . . . 15.640000000000001 110.067 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -94.72 72.03 3.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.878 1.271 . . . . 10.99 112.957 -171.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.6 136.34 40.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.823 -1.173 . . . . 5.3399999999999999 111.679 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.39 11.56 68.19 Favored Glycine 0 CA--C 1.54 1.625 0 O-C-N 120.929 -1.107 . . . . 4.96 114.5 -178.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -94.29 -10.66 32.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.678 1.591 . . . . 5.6600000000000001 114.058 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt -105.5 -23.97 12.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.814 1.246 . . . . 3.5699999999999998 112.218 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.452 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 3.1299999999999999 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.8200000000000003 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 2.8300000000000001 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.9299999999999999 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 5.5899999999999999 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.1100000000000003 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 2.4100000000000001 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 7.3499999999999996 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 6.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.97 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 -41.24 86.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 4.0300000000000002 111.525 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.16 -39.1 96.82 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.689 1.138 . . . . 2.8300000000000001 112.883 172.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -65.81 -38.36 88.74 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.369 1.068 . . . . 6.3899999999999997 112.333 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -84.05 -39.18 19.91 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.453 1.279 . . . . 6.1200000000000001 114.453 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.548 -1.691 . . . . 7.8399999999999999 112.115 -173.279 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 118.767 -0.635 . . . . 4.54 111.425 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.55 10.56 40.78 Favored Glycine 0 CA--C 1.537 1.421 0 N-CA-C 116.278 1.271 . . . . 3.2200000000000002 116.278 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.37 153.41 31.19 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.8 1.8 . . . . 2.8799999999999999 112.995 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.4399999999999999 110.374 165.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 3.1099999999999999 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.491 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.4299999999999999 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -86.82 -15.83 38.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.6499999999999999 114.222 -171.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.8 t -77.84 126.0 84.74 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 119.401 1.0 . . . . 5.29 109.076 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.94 -29.18 34.83 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.781 1.654 . . . . 5.9900000000000002 115.408 -155.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.52 -49.52 26.12 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.527 1.058 . . . . 4.8200000000000003 112.689 -172.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt -67.73 -42.43 81.89 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.565 1.146 . . . . 3.5699999999999998 110.232 165.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.5600000000000001 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 3.6899999999999999 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 1.6299999999999999 113.709 177.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.3600000000000001 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 1.1899999999999999 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.5800000000000001 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65000000000000002 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.69999999999999996 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.8899999999999997 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 1.4299999999999999 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 3.1499999999999999 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.491 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 1.77 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.82999999999999996 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 1.53 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 3.27 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 2.6499999999999999 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.46999999999999997 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 3.3799999999999999 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 4.8700000000000001 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 4.1699999999999999 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.96999999999999997 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 2.3399999999999999 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.4900000000000002 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.3600000000000003 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.8799999999999999 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 3.1299999999999999 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 1.1899999999999999 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.6499999999999999 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.60999999999999999 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 3.1299999999999999 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.9199999999999999 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.79000000000000004 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 2.9399999999999999 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 4.29 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 1.5600000000000001 113.604 172.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 3.1400000000000001 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 4.4500000000000002 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.6899999999999999 115.592 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.68999999999999995 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt -75.42 -23.89 57.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 3.0800000000000001 111.014 -167.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -57.93 -19.2 28.25 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.314 1.845 . . . . 1.48 113.818 171.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -74.6 -20.04 60.08 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.279 1.955 . . . . 3.46 116.279 173.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -140.37 116.45 7.82 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 118.991 0.814 . . . . 3.3999999999999999 111.758 -164.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.05 -53.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 121.504 1.469 . . . . 2.4199999999999999 113.573 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -162.77 64.66 0.2 Allowed 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 124.598 2.142 . . . . 4.6100000000000003 110.151 -173.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.272 1.1 tm? -116.02 -13.3 11.24 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 110.92 -2.854 . . . . 2.8700000000000001 110.755 -156.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.193 2.597 . . . . 3.7000000000000002 111.683 -167.405 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 111.07 0.026 . . . . 17.68 111.07 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 19.4 m80 55.43 53.99 9.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.617 1.967 . . . . 17.600000000000001 113.545 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 24.5 p -65.41 -7.94 16.35 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 116.553 2.057 . . . . 8.5199999999999996 116.553 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.79 -170.75 42.16 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.062 1.791 . . . . 5.4699999999999998 111.7 176.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -88.72 -37.58 15.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.136 1.161 . . . . 7.0899999999999999 114.136 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.311 2.5 pt? -77.57 -21.18 52.88 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 3.71 114.413 -177.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 3.3300000000000001 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.6100000000000003 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 2.75 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.8700000000000001 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 4.2699999999999996 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.9500000000000002 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 3.1000000000000001 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.8799999999999999 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 8.1400000000000006 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 2.4900000000000002 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp -59.71 -55.87 28.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 4.5999999999999996 110.145 168.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -55.9 -35.64 64.2 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.185 0.898 . . . . 2.29 113.345 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -65.63 -59.52 3.85 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.283 1.433 . . . . 6.8200000000000003 112.001 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.52 -9.42 59.77 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.568 1.692 . . . . 6.6900000000000004 115.568 -172.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.173 -1.394 . . . . 4.5499999999999998 112.322 169.185 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.461 0.648 . . . . 5.6900000000000004 112.724 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.69 -2.56 2.48 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.117 1.817 . . . . 3.2400000000000002 116.454 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -102.43 171.63 7.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.073 1.436 . . . . 3.4300000000000002 114.041 -163.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.1200000000000001 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.552 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.65 151.95 19.58 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.8700000000000001 113.588 -170.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.251 0.0 OUTLIER 62.73 156.17 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.59 1.956 . . . . 5.6799999999999997 113.723 -164.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.03 25.11 0.57 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.925 2.417 . . . . 6.54 114.998 -164.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.64 -66.28 0.72 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.264 1.425 . . . . 3.3599999999999999 110.45 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp -95.36 -23.09 17.33 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 2.5699999999999998 112.365 160.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.0900000000000001 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.3400000000000001 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 3.2599999999999998 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 1.76 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.1899999999999999 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 1.02 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 2.0699999999999998 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.82999999999999996 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.77000000000000002 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.1099999999999999 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.84999999999999998 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 2.71 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.552 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 1.3899999999999999 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.98999999999999999 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 1.5900000000000001 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 3.29 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 2.54 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.40000000000000002 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 3.6400000000000001 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 3.7400000000000002 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 4.1799999999999997 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.72999999999999998 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 2.2799999999999998 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.0099999999999998 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 2.8199999999999998 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 2.8999999999999999 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 2.29 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.5800000000000001 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.53000000000000003 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 2.9399999999999999 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.4700000000000002 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.96999999999999997 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 2.9500000000000002 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 6.2800000000000002 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 1.5700000000000001 113.626 171.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 3.1600000000000001 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.5599999999999996 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79000000000000004 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp -78.26 -22.29 48.58 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 4.79 110.722 -167.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -55.03 -23.8 21.53 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.038 1.735 . . . . 2.0099999999999998 113.215 169.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -57.49 -39.83 77.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.076 0.951 . . . . 4.1699999999999999 113.067 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -146.87 121.06 5.13 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.774 1.027 . . . . 4.1900000000000004 113.774 -158.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -85.17 -35.1 0.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 121.947 1.765 . . . . 2.8500000000000001 114.673 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -162.32 66.5 0.23 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 123.125 1.44 . . . . 4.0099999999999998 111.488 -165.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.255 0.1 OUTLIER -128.4 -13.56 4.89 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 113.79 -1.55 . . . . 2.6499999999999999 111.621 -161.648 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 127.079 2.152 . . . . 3.8100000000000001 110.946 -163.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.448 0.642 . . . . 9.8000000000000007 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -78.89 -29.89 44.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.877 -0.514 . . . . 12.380000000000001 111.187 167.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.47 36.83 6.46 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.133 1.373 . . . . 5.0899999999999999 113.467 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.1 -14.04 30.28 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.412 1.958 . . . . 4.7599999999999998 115.772 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -55.62 -27.59 50.41 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.57 1.148 . . . . 7.9500000000000002 113.214 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER -138.11 -23.96 1.01 Allowed 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 3.7599999999999998 114.943 165.257 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 2.8300000000000001 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.5299999999999998 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 2.4300000000000002 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 2.0899999999999999 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 5.9900000000000002 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.7300000000000004 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.5800000000000001 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 4.3600000000000003 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 9.0199999999999996 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 2.21 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.87 -41.93 88.21 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 4.6799999999999997 111.172 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.49 -36.86 59.12 Favored Glycine 0 CA--C 1.535 1.344 0 CA-C-N 118.954 0.797 . . . . 2.1000000000000001 114.387 171.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -80.98 -19.01 44.97 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.037 1.418 . . . . 7.5800000000000001 114.029 172.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.97 -24.12 38.28 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.476 1.658 . . . . 5.7199999999999998 115.476 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 mm . . . . . 0 N--CA 1.492 1.659 0 CA-C-N 121.279 1.854 . . . . 5.1299999999999999 111.773 177.868 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 31.7 t30 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 119.024 -0.512 . . . . 5.5099999999999998 112.036 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.54 22.67 76.64 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.069 0.849 . . . . 3.8100000000000001 114.074 177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -93.19 161.75 14.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.935 1.694 . . . . 5.3200000000000003 113.274 -165.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.5299999999999998 111.937 172.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.0099999999999998 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -146.81 159.83 43.02 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.2 p 58.76 -176.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 125.683 1.593 . . . . 5.0599999999999996 114.662 -172.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.7 53.55 4.83 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 123.681 2.921 . . . . 7.1200000000000001 112.611 -173.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.5 m -126.7 -98.49 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.958 2.103 . . . . 4.54 111.732 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp -91.22 -14.14 31.54 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.007 1.731 . . . . 2.9500000000000002 113.406 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.4099999999999999 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 5.0199999999999996 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 2.1899999999999999 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.8600000000000001 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.1599999999999999 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.96 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.0900000000000001 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.49 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.1200000000000001 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.1899999999999999 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 2.9399999999999999 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 1.9299999999999999 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 1.22 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 1.51 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 3.3599999999999999 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 2.0099999999999998 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.57999999999999996 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 3.54 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 3.5600000000000001 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 4.3499999999999996 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 2.29 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.7799999999999998 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.6099999999999999 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 2.6499999999999999 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 2.73 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.3 115.808 177.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.4099999999999999 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.3700000000000001 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.54000000000000004 114.561 -178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 3.0499999999999998 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.2400000000000002 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.68999999999999995 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 3.0899999999999999 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 6.4500000000000002 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 1.9399999999999999 113.351 167.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 4.3899999999999997 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 4.6299999999999999 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.90000000000000002 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp -74.33 -30.71 62.16 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 6.0800000000000001 111.269 -170.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -71.81 -13.83 61.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.925 2.09 . . . . 3.1200000000000001 114.019 178.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -80.89 -24.71 38.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.678 0.992 . . . . 4.7699999999999996 113.678 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -120.31 118.28 31.3 Favored Pre-proline 0 C--O 1.237 0.446 0 N-CA-C 113.533 0.938 . . . . 4.1500000000000004 113.533 -169.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -77.57 -26.76 6.81 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 122.704 2.269 . . . . 5.79 113.364 166.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -166.54 1.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 120.517 1.508 . . . . 8.7899999999999991 115.017 -151.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -5.45 29.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.798 1.639 . . . . 5.2300000000000004 113.604 -170.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 129.141 2.976 . . . . 5.54 113.562 -163.661 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 118.998 -0.525 . . . . 16.300000000000001 110.157 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -71.93 81.19 0.92 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.219 1.408 . . . . 16.66 113.006 -172.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 26.1 p -167.36 162.59 14.84 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.534 1.933 . . . . 9.8900000000000006 110.998 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -173.6 -95.01 0.1 OUTLIER Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.279 -0.888 . . . . 6.9199999999999999 113.527 172.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -53.32 -17.41 1.8 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 115.648 1.721 . . . . 8.1500000000000004 115.648 -176.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.72 -23.43 63.16 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 4.6699999999999999 114.281 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 5.0499999999999998 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.3600000000000003 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 3.02 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 4.5300000000000002 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.9000000000000004 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.7200000000000002 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 3.1099999999999999 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 4.5 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 8.0999999999999996 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 2.2999999999999998 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.19 -49.37 77.89 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 5.0999999999999996 110.771 171.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.78 -28.53 63.22 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 119.349 -0.695 . . . . 3.3199999999999998 114.5 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -79.13 -39.79 32.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.889 1.676 . . . . 5.0899999999999999 113.311 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -81.96 -23.04 36.32 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.151 1.537 . . . . 5.7800000000000002 115.151 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 tt . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.6 -1.191 . . . . 5.6900000000000004 113.216 -175.345 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.391 -0.814 . . . . 4.9500000000000002 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.28 27.84 67.26 Favored Glycine 0 CA--C 1.538 1.469 0 CA-C-N 120.631 1.56 . . . . 2.98 113.683 -170.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -136.06 166.73 22.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.2599999999999998 114.46 -169.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.464 HG23 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.5499999999999998 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 4.2599999999999998 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.555 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.6899999999999999 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -61.63 -18.58 60.06 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.8799999999999999 113.567 174.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 67.0 m -75.24 127.25 86.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.377 1.071 . . . . 4.7599999999999998 111.386 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -57.14 -19.02 31.7 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.114 3.209 . . . . 5.5999999999999996 116.822 -171.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 p -53.23 -48.19 68.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.51 1.124 . . . . 4.04 112.865 168.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.0 mp -103.34 -18.11 14.99 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.263 1.025 . . . . 2.3900000000000001 112.544 174.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 3.54 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 1.6200000000000001 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.3400000000000001 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 1.0600000000000001 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.74 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.77000000000000002 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.88 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.0899999999999999 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.3600000000000001 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 2.9500000000000002 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 1.75 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 1.3100000000000001 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 1.5900000000000001 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 4.2000000000000002 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 2.7200000000000002 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.45000000000000001 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 3.25 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 4.79 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 3.8100000000000001 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.69999999999999996 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 2.1699999999999999 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.8799999999999999 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1000000000000001 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 2.8300000000000001 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 2.3900000000000001 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.8500000000000001 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.9199999999999999 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.1800000000000002 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.85999999999999999 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 2.6299999999999999 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.8400000000000001 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.73999999999999999 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 3.4900000000000002 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 5.1299999999999999 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 1.6899999999999999 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 3.52 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 4.2800000000000002 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.6699999999999999 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.96999999999999997 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt -75.97 -22.78 55.53 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.8900000000000001 111.832 -168.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -58.74 -15.36 11.76 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.253 1.821 . . . . 1.6000000000000001 113.369 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -70.25 -27.65 64.61 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.357 1.463 . . . . 4.9000000000000004 114.877 172.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -142.33 121.68 7.85 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 124.251 1.021 . . . . 3.8100000000000001 111.434 -170.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.78 -47.02 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.928 1.752 . . . . 2.3999999999999999 113.312 -170.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -158.34 52.96 0.43 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 124.074 1.892 . . . . 3.79 113.542 -165.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.271 0.5 OUTLIER -116.71 -10.4 11.13 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.056 2.143 . . . . 2.6299999999999999 111.463 -157.156 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 60' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.256 1.404 0 C-N-CA 125.941 1.696 . . . . 3.4399999999999999 112.74 -165.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.483 1.222 0 N-CA-C 112.549 0.574 . . . . 14.140000000000001 112.549 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -139.87 -4.12 1.4 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.704 2.001 . . . . 9.3200000000000003 114.72 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.1 t 63.69 -23.58 0.07 Allowed 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 117.574 2.435 . . . . 7.4900000000000002 117.574 176.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.37 -170.51 31.39 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.534 1.54 . . . . 6.6600000000000001 115.333 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -79.07 -2.33 39.96 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.016 1.858 . . . . 5.8099999999999996 116.016 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -54.81 -27.61 43.1 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 3.4199999999999999 115.009 -169.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 3.79 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.0800000000000001 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 2.54 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.9199999999999999 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 5.6399999999999997 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.0199999999999996 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 3.3999999999999999 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 5.1299999999999999 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 7.71 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.76 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.05 -47.69 83.6 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 5.3099999999999996 111.756 170.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.94 -32.14 62.07 Favored Glycine 0 CA--C 1.538 1.483 0 O-C-N 121.493 -0.754 . . . . 2.5499999999999998 114.037 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -81.58 -28.53 33.76 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.639 1.576 . . . . 5.1200000000000001 113.403 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -87.23 -19.13 28.78 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 127.576 2.351 . . . . 5.1299999999999999 115.327 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 124.51 1.124 . . . . 6.1600000000000001 110.18 165.306 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 118.46 -0.781 . . . . 6.1500000000000004 111.411 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.4 ' HA3' ' CD1' ' A' ' 32' ' ' TYR . . . 57.61 21.09 41.38 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.017 1.77 . . . . 4.0 116.775 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -90.98 -19.37 23.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.5600000000000001 116.694 -161.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.409 HG23 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.3199999999999998 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.502 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.1400000000000001 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.24 4.78 37.29 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.3100000000000001 113.426 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.9 m -86.93 -71.43 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 CA-C-O 117.197 -1.382 . . . . 7.2999999999999998 112.319 173.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.38 177.15 8.28 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.639 2.226 . . . . 8.9199999999999999 110.942 169.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.7 p -74.61 31.19 0.09 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.533 1.679 . . . . 4.3300000000000001 115.533 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp -70.98 -16.97 62.67 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.479 -1.388 . . . . 3.0800000000000001 114.301 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.6000000000000001 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.6399999999999999 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 3.0699999999999998 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 1.76 115.095 -167.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.9099999999999999 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.98999999999999999 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 1.3 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56999999999999995 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.63 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.8199999999999998 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.81000000000000005 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 2.8599999999999999 112.854 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.502 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 1.8500000000000001 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.93999999999999995 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 1.6499999999999999 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 3.3399999999999999 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 3.2400000000000002 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.41999999999999998 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.428 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 4.0700000000000003 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.8300000000000001 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' CD1' ' HA3' ' A' ' 2' ' ' GLY . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 3.75 113.339 162.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.69999999999999996 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 2.0600000000000001 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.2599999999999998 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.7599999999999998 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 4.8300000000000001 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 3.9700000000000002 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.97 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.6600000000000001 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.4700000000000002 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.57999999999999996 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 2.52 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.8999999999999999 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76000000000000001 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 3.2400000000000002 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 4.3499999999999996 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 1.6899999999999999 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 3.2400000000000002 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.6600000000000001 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.5499999999999998 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66000000000000003 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt -79.58 -17.82 53.06 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 3.1499999999999999 111.933 -168.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -61.51 -21.75 64.51 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.889 1.676 . . . . 1.55 113.352 167.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -62.33 -38.24 88.7 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.168 1.387 . . . . 3.0899999999999999 112.852 174.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.2 m-85 -133.01 131.62 21.99 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.111 0.782 . . . . 3.4900000000000002 113.111 -165.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.89 -48.47 0.15 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.778 2.319 . . . . 2.6099999999999999 113.292 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -156.02 9.08 0.25 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.323 1.849 . . . . 4.0300000000000002 111.787 -165.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.412 ' CD1' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -79.89 -14.04 58.94 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 119.466 -2.021 . . . . 2.3900000000000001 115.435 -141.558 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.412 ' CD2' ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 C-N-CA 126.175 1.79 . . . . 4.25 113.416 -160.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.195 -0.298 . . . . 10.77 110.195 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -81.55 -21.5 38.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.753 1.76 . . . . 10.93 115.753 -172.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 43.5 t -73.46 135.1 44.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.897 0.771 . . . . 4.7699999999999996 112.273 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.9 -2.27 0.03 OUTLIER Glycine 0 CA--C 1.54 1.599 0 N-CA-C 116.178 1.231 . . . . 4.5199999999999996 116.178 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -66.44 -32.37 73.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.722 1.761 . . . . 6.4699999999999998 114.201 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt -76.83 -34.16 57.91 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.34 0.973 . . . . 3.6299999999999999 110.872 173.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 4.1200000000000001 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.1399999999999997 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 2.1600000000000001 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.8 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 5.4299999999999997 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.9400000000000004 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.52 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 4.4699999999999998 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 9.1500000000000004 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 2.0299999999999998 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.55 -46.09 89.91 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 4.2599999999999998 110.621 174.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.78 -35.74 87.46 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.887 1.232 . . . . 1.8700000000000001 114.576 178.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -76.49 -34.88 58.63 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.596 1.198 . . . . 4.8399999999999999 112.394 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -69.65 -29.55 67.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.491 0.922 . . . . 5.5300000000000002 113.491 173.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 C--O 1.254 1.297 0 CA-C-O 116.699 -1.619 . . . . 4.5 112.757 177.979 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 112.779 0.659 . . . . 4.9299999999999997 112.779 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.56 -42.22 0.42 Allowed Glycine 0 CA--C 1.541 1.694 0 C-N-CA 126.473 1.987 . . . . 3.1299999999999999 113.857 -169.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -25.88 147.27 0.0 OUTLIER 'General case' 0 C--O 1.236 0.361 1 C-N-CA 131.94 4.096 . . . . 4.8799999999999999 116.396 168.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.5600000000000001 111.815 170.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.73 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.531 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.3500000000000001 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.89 -23.87 62.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 113.301 175.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -67.84 123.52 87.24 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 118.312 -0.851 . . . . 6.0199999999999996 109.947 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -62.32 -34.91 76.16 Favored 'Trans proline' 0 C--N 1.355 0.917 0 N-CA-C 117.76 2.177 . . . . 5.0999999999999996 117.76 -156.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.28 -55.69 5.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.544 0.737 . . . . 4.2400000000000002 112.095 -173.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.62 -41.63 99.12 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.839 1.655 . . . . 3.1400000000000001 109.905 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.73 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.4099999999999999 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 3.4100000000000001 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.75 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.48 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.27 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 2.2400000000000002 115.635 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.1599999999999999 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 1.1699999999999999 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.6800000000000002 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.53 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 2.6200000000000001 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 1.5600000000000001 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.93999999999999995 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 1.74 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 3.5 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.8899999999999999 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.47999999999999998 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 5.0099999999999998 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 5.0099999999999998 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 4.1100000000000003 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.85999999999999999 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 2.1600000000000001 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.8300000000000001 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 3.7799999999999998 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 3.4300000000000002 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.77 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.6200000000000001 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.58999999999999997 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 2.6800000000000002 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.0800000000000001 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67000000000000004 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 2.96 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 4.1600000000000001 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 1.72 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 3.48 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 4.04 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.9100000000000001 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm -74.8 -18.84 60.4 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 5.5999999999999996 111.839 -169.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -73.42 -27.25 61.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.469 1.908 . . . . 1.3700000000000001 113.289 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -67.48 -31.94 72.42 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.479 1.659 . . . . 3.6200000000000001 115.479 -171.042 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -118.71 126.56 27.07 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 123.025 0.53 . . . . 4.2400000000000002 112.013 -161.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -86.38 -21.82 2.28 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.082 2.521 . . . . 5.0899999999999999 113.815 175.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.08 -2.22 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.046 1.498 . . . . 8.3599999999999994 115.046 -150.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.76 -8.71 59.57 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.737 1.215 . . . . 4.1200000000000001 113.22 -161.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 C--O 1.251 1.175 0 C-N-CA 127.553 2.341 . . . . 4.79 113.817 -163.84 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.539 -0.171 . . . . 13.18 110.539 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -62.68 144.15 56.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.922 0.889 . . . . 11.02 112.503 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 48.5 t -83.18 -51.83 7.14 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.926 0.891 . . . . 4.7300000000000004 110.544 167.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.01 143.78 3.77 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.469 1.033 . . . . 5.2300000000000004 114.516 171.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 53.3 t60 -67.14 -35.38 79.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.728 1.211 . . . . 6.1500000000000004 113.111 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -88.42 -10.31 49.63 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 5.4500000000000002 115.285 -163.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 3.5600000000000001 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.2599999999999998 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 2.3100000000000001 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 2.2999999999999998 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 5.3499999999999996 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.3700000000000001 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 2.9300000000000002 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 4.1799999999999997 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 6.6600000000000001 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 2.0099999999999998 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -65.55 -48.74 71.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 4.9199999999999999 110.85 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.16 91.52 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 123.496 0.569 . . . . 1.9299999999999999 113.006 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -66.14 -40.32 90.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.258 1.423 . . . . 4.5 112.844 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -73.15 -40.97 64.44 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.438 1.644 . . . . 3.7799999999999998 115.438 -177.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 pt . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 115.869 1.803 . . . . 5.1299999999999999 115.869 -170.518 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 117.601 -1.19 . . . . 5.7400000000000002 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.69 19.64 55.23 Favored Glycine 0 CA--C 1.537 1.409 0 CA-C-N 120.13 1.332 . . . . 2.98 113.832 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -118.33 159.18 23.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.302 1.841 . . . . 3.2599999999999998 112.284 -157.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.5499999999999998 111.105 177.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 4.04 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.6 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.5899999999999999 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -95.19 -47.91 6.15 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.5099999999999998 115.389 -151.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.3 t -153.34 -56.86 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 125.357 1.463 . . . . 7.4299999999999997 109.774 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -63.33 169.44 9.5 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.046 1.83 . . . . 6.46 111.714 159.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.6 m 48.55 -101.58 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.646 1.578 . . . . 6.6600000000000001 113.616 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 mp -93.43 8.42 40.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.378 1.471 . . . . 2.75 114.06 -171.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.46 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.8999999999999999 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 3.6699999999999999 114.782 -175.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.8899999999999999 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.8200000000000001 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.5 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 2.0600000000000001 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 1.02 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.73999999999999999 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 3.23 112.357 168.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.6 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 1.8300000000000001 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.93999999999999995 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 1.6299999999999999 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 3.4399999999999999 113.151 -178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 2.8700000000000001 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51000000000000001 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 3.7999999999999998 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 3.6499999999999999 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 3.8599999999999999 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.98999999999999999 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 2.3199999999999998 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.9500000000000002 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.0800000000000001 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 2.7000000000000002 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 2.5499999999999998 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 2.0 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.8500000000000001 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.1099999999999999 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.54000000000000004 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 2.6000000000000001 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.3300000000000001 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.68999999999999995 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 3.04 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 5.2699999999999996 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 2.02 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 4.5599999999999996 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 4.8200000000000003 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.5099999999999998 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt -74.91 -21.73 59.04 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 2.7799999999999998 111.923 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -56.74 -17.73 10.06 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.503 1.921 . . . . 2.3100000000000001 113.519 167.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -68.92 -29.82 68.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.763 1.625 . . . . 4.0199999999999996 114.48 172.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -145.41 125.36 7.07 Favored Pre-proline 0 N--CA 1.471 0.603 0 CA-C-N 118.889 0.768 . . . . 4.1600000000000001 112.874 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -88.73 -30.91 0.19 Allowed 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.288 1.992 . . . . 2.96 115.95 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -161.5 59.96 0.27 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.527 1.156 . . . . 4.5199999999999996 113.369 -163.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.281 0.7 OUTLIER -137.51 -10.44 1.64 Allowed 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 114.353 -1.294 . . . . 2.4300000000000002 111.922 -156.732 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.3 p90 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 126.709 2.004 . . . . 4.0899999999999999 112.704 -166.631 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 111.261 0.097 . . . . 19.390000000000001 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -129.16 145.65 51.27 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.341 1.457 . . . . 14.77 113.657 -173.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.9 t -57.09 -34.94 68.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.591 1.556 . . . . 9.7300000000000004 113.996 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.53 -20.29 78.32 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 115.681 1.032 . . . . 5.7400000000000002 115.681 176.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -121.8 -25.11 5.1 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.956 1.465 . . . . 6.8899999999999997 114.956 -170.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp -55.86 -22.01 22.95 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.751 1.16 . . . . 4.3300000000000001 113.968 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 4.3799999999999999 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.3200000000000003 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 2.52 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 4.25 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.96 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.0300000000000002 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.7599999999999998 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 4.4699999999999998 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 10.390000000000001 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 2.71 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.64 -44.26 94.37 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 4.71 111.563 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.3 -32.0 71.92 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.306 0.955 . . . . 2.77 113.778 174.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -70.13 -37.59 75.34 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.384 1.473 . . . . 6.0099999999999998 112.993 173.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -72.03 -43.92 64.22 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.344 1.058 . . . . 6.1299999999999999 112.974 173.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.381 11.1 tp . . . . . 0 N--CA 1.481 1.116 0 C-N-CA 129.25 3.02 . . . . 6.75 114.903 -170.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 118.661 -0.685 . . . . 3.9500000000000002 110.535 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 24.43 46.84 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.31 0.959 . . . . 2.54 115.056 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -69.69 156.64 38.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.839 1.319 . . . . 3.1000000000000001 113.502 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.7799999999999998 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.555 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.3400000000000001 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.59 -22.22 66.91 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.4500000000000002 112.442 168.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.8 p -70.44 120.03 76.03 Favored Pre-proline 0 CA--C 1.546 0.791 0 O-C-N 121.353 -0.842 . . . . 5.6500000000000004 110.767 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.42 -17.2 44.05 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 5.1100000000000003 114.675 -160.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.69 -27.5 64.05 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.266 -0.896 . . . . 3.1099999999999999 112.603 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -98.15 -24.25 15.37 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.604 1.093 . . . . 2.3900000000000001 112.341 159.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.1599999999999999 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.4099999999999999 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.44 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.9100000000000001 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 1.79 113.445 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.0800000000000001 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.97999999999999998 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.4099999999999999 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55000000000000004 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.93000000000000005 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.8300000000000001 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 1.04 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.44 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 2.7000000000000002 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 1.6200000000000001 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 2.23 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 1.6100000000000001 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 3.3999999999999999 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.8899999999999999 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.40999999999999998 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 4.1299999999999999 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 3.5800000000000001 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 3.4500000000000002 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.76000000000000001 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 2.1299999999999999 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.5299999999999998 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.9399999999999999 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 3.2000000000000002 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 2.79 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.6499999999999999 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 2.0 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.7599999999999998 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.79000000000000004 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 2.3100000000000001 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.8200000000000001 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.71999999999999997 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 2.8799999999999999 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 4.6100000000000003 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 1.77 112.231 172.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 3.5299999999999998 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.7300000000000004 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.70999999999999996 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt -78.32 -15.71 58.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.9500000000000002 112.229 -168.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -52.8 -23.47 6.97 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.445 1.898 . . . . 1.79 113.377 164.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -68.78 -42.15 77.78 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.787 1.235 . . . . 4.1900000000000004 113.063 175.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -139.22 117.35 8.88 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.969 1.1 . . . . 3.4300000000000002 113.969 -163.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -81.67 -26.99 2.84 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.55 2.833 . . . . 2.4399999999999999 114.726 -168.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -157.34 1.79 0.12 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.47 1.508 . . . . 4.2599999999999998 113.927 -171.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.34 -8.78 59.8 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 119.791 -1.818 . . . . 2.3799999999999999 114.456 -140.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.388 2.275 . . . . 4.0899999999999999 113.847 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.529 -0.545 . . . . 11.08 109.529 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -121.91 -22.29 5.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.353 1.461 . . . . 9.3900000000000006 113.476 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.4 m -55.08 138.35 44.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.359 0.981 . . . . 4.5700000000000003 111.161 175.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.89 -152.98 11.77 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.909 1.243 . . . . 4.2199999999999998 110.495 -170.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 49.4 t60 37.88 -85.98 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.097 2.559 . . . . 7.1500000000000004 115.109 174.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -53.08 -33.59 52.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.38 1.446 . . . . 3.3900000000000001 113.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 3.3599999999999999 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.6400000000000001 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 2.52 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 2.04 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 5.3300000000000001 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.5600000000000001 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 2.1200000000000001 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 3.4100000000000001 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 6.1600000000000001 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 1.8899999999999999 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt -72.42 -43.74 63.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 4.0800000000000001 111.892 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.09 -39.12 91.66 Favored Glycine 0 CA--C 1.535 1.309 0 CA-C-N 118.826 0.739 . . . . 1.7 113.152 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -67.11 -38.35 85.48 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.369 1.068 . . . . 4.8200000000000003 112.759 171.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -70.25 -31.16 68.42 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 117.336 -1.316 . . . . 4.2300000000000004 114.081 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 70.7 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.468 -1.253 . . . . 5.3200000000000003 112.374 176.446 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 118.979 -0.534 . . . . 4.1799999999999997 110.671 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.21 23.24 57.29 Favored Glycine 0 CA--C 1.536 1.397 0 CA-C-N 119.355 0.98 . . . . 2.6600000000000001 114.929 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.2 150.07 44.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.161 1.481 . . . . 2.9700000000000002 114.007 -173.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.9500000000000002 112.803 179.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.5499999999999998 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.477 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -115.64 -12.33 11.59 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.5099999999999998 113.008 167.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 86.8 p -60.46 156.88 39.35 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.621 1.168 . . . . 5.8799999999999999 113.658 -176.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.84 131.3 41.44 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 6.3200000000000003 115.066 -165.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 56.4 m 60.45 -38.24 0.09 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.861 3.264 . . . . 5.1600000000000001 116.056 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.85 -35.19 72.53 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.041 1.337 . . . . 3.5099999999999998 110.553 168.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.6299999999999999 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 2.8100000000000001 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 1.6599999999999999 114.814 -172.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.9199999999999999 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 1.0800000000000001 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.454 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.8999999999999999 114.525 166.449 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81000000000000005 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.88 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.8099999999999996 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 1.1299999999999999 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 3.0699999999999998 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 1.49 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.95999999999999996 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 1.5900000000000001 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 3.25 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.9299999999999999 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.40999999999999998 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 4.0700000000000003 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 3.6299999999999999 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 3.6400000000000001 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.94999999999999996 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 2.1699999999999999 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.6200000000000001 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.8500000000000001 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 3.04 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 3.23 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.8 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.76 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.9700000000000002 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.73999999999999999 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 3.3999999999999999 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.1200000000000001 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 2.9500000000000002 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 6.5999999999999996 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 1.6399999999999999 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 3.27 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.6200000000000001 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.0600000000000001 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.68999999999999995 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt -79.74 -21.0 45.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.73 112.078 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.56 -11.81 12.77 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.584 1.954 . . . . 1.6000000000000001 113.368 168.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.57 -40.31 50.03 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.17 1.788 . . . . 4.71 114.582 173.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -136.39 119.22 12.02 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 118.884 0.765 . . . . 3.4900000000000002 111.904 -164.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -88.7 -31.84 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.235 1.957 . . . . 2.3100000000000001 116.313 -171.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -161.93 75.85 0.48 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 123.049 1.404 . . . . 4.0300000000000002 112.012 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.299 1.2 tm? -138.03 -8.41 1.58 Allowed 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.246 -1.343 . . . . 2.5800000000000001 111.61 -161.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.454 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 6.6 p90 . . . . . 0 C--O 1.257 1.457 0 C-N-CA 127.466 2.307 . . . . 4.0700000000000003 114.478 -166.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 119.782 -0.152 . . . . 13.130000000000001 111.344 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -82.22 55.62 2.92 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.0 1.32 . . . . 10.859999999999999 111.837 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -70.92 -40.87 71.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.135 0.974 . . . . 5.1399999999999997 112.092 -176.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -80.16 18.41 8.11 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 116.222 1.249 . . . . 4.6299999999999999 116.222 -171.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -63.37 -33.38 75.4 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.039 1.496 . . . . 5.8200000000000003 115.039 -168.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt -111.69 -23.47 10.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.775 1.23 . . . . 4.0099999999999998 113.272 175.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 2.8100000000000001 114.833 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 2.02 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.8600000000000001 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 6.1399999999999997 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.4699999999999998 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 2.1499999999999999 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 4.1799999999999997 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 6.8200000000000003 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.77 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.66 -46.38 85.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 5.0 112.13 174.072 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.9 -27.93 67.68 Favored Glycine 0 CA--C 1.539 1.542 0 CA-C-N 118.984 0.811 . . . . 2.23 114.39 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -82.12 -32.5 30.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.255 1.022 . . . . 4.54 112.63 172.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -72.84 -44.34 61.54 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.513 1.301 . . . . 4.75 114.513 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 117.898 -1.048 . . . . 5.9299999999999997 113.715 -173.913 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 118.212 -0.899 . . . . 4.7999999999999998 111.067 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.13 14.68 59.59 Favored Glycine 0 CA--C 1.54 1.655 0 CA-C-N 120.141 1.337 . . . . 3.4199999999999999 115.906 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -74.23 167.95 20.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.116 1.766 . . . . 3.75 113.447 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.0099999999999998 110.334 162.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.3700000000000001 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.524 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.3100000000000001 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -146.61 157.35 43.7 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.29 110.183 -174.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.9 t 64.36 130.64 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 127.535 2.334 . . . . 5.7599999999999998 112.734 -154.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.43 -14.46 37.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.165 2.577 . . . . 6.6299999999999999 115.942 -159.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.4 p -57.11 -51.21 70.21 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.789 1.177 . . . . 3.6899999999999999 112.812 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt -95.57 -31.42 13.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.839 1.656 . . . . 2.98 110.666 166.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.3200000000000001 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.4099999999999999 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 2.5899999999999999 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 1.76 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 1.0700000000000001 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 2.0600000000000001 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.70999999999999996 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.56000000000000005 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.0300000000000002 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.80000000000000004 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 3.8399999999999999 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.524 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 2.0299999999999998 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.81000000000000005 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 1.5600000000000001 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 3.4900000000000002 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.8200000000000001 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53000000000000003 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 3.71 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 3.52 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 3.4100000000000001 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.1599999999999999 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 2.3100000000000001 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.1400000000000001 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.3199999999999998 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 3.3399999999999999 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 2.8399999999999999 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.8100000000000001 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.8999999999999999 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2000000000000002 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.64000000000000001 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 3.1600000000000001 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.5699999999999998 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.81999999999999995 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 3.5600000000000001 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 4.2199999999999998 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 1.52 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 3.46 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 4.0899999999999999 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.4300000000000002 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64000000000000001 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp -78.9 -19.61 51.44 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 4.4400000000000004 111.655 -170.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -62.42 -14.38 40.04 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.727 1.611 . . . . 1.4299999999999999 113.866 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -65.45 -37.68 87.6 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.355 0.98 . . . . 3.4900000000000002 113.327 172.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -142.75 132.24 11.97 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.729 1.011 . . . . 4.0499999999999998 113.729 -159.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -93.06 -36.11 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.931 2.421 . . . . 2.3100000000000001 115.484 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -154.59 65.95 0.68 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.298 1.523 . . . . 5.1100000000000003 111.687 -157.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.27 0.3 OUTLIER -145.45 -8.54 0.58 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 112.842 -1.981 . . . . 2.3900000000000001 110.587 -156.155 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.25 1.1 0 C-N-CA 127.487 2.315 . . . . 3.6400000000000001 112.983 -165.859 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.271 0.081 . . . . 11.57 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -59.28 -31.8 69.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.58 1.552 . . . . 12.050000000000001 113.891 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.4 t -157.66 148.63 21.29 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.488 1.515 . . . . 5.1900000000000004 110.611 -176.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 171.93 -7.39 0.04 OUTLIER Glycine 0 CA--C 1.537 1.451 0 N-CA-C 118.435 2.134 . . . . 4.1600000000000001 118.435 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -88.14 -43.09 11.91 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.265 2.033 . . . . 6.6699999999999999 113.928 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -59.07 -35.78 73.95 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 4.2999999999999998 114.209 -173.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 3.3599999999999999 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.9199999999999999 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 2.25 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.96 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 4.0899999999999999 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.7599999999999998 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 2.4100000000000001 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 3.3599999999999999 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 5.6100000000000003 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 1.8799999999999999 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.37 -51.65 57.77 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.9100000000000001 110.439 167.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.97 -36.0 54.99 Favored Glycine 0 CA--C 1.54 1.613 0 CA-C-O 119.461 -0.633 . . . . 2.0499999999999998 114.635 174.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -80.56 -21.99 41.2 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.317 1.559 . . . . 6.8300000000000001 114.833 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -102.03 -27.29 13.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.601 1.704 . . . . 5.1600000000000001 115.601 -178.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 10.9 tp . . . . . 0 C--O 1.256 1.403 0 C-N-CA 125.205 1.402 . . . . 4.3499999999999996 114.265 -171.766 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 119.863 -0.113 . . . . 5.8700000000000001 110.737 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.06 26.1 53.8 Favored Glycine 0 CA--C 1.534 1.253 0 O-C-N 121.376 -0.827 . . . . 4.7699999999999996 114.931 -175.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -57.22 170.24 0.5 Allowed 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.039 0.919 . . . . 3.6600000000000001 113.395 176.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.9100000000000001 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.601 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -137.09 -49.85 0.63 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.8300000000000001 115.113 -169.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.3 m -79.43 -34.74 0.93 Allowed Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 116.047 1.869 . . . . 5.1100000000000003 116.047 -173.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -79.4 178.23 7.64 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.736 2.291 . . . . 8.7300000000000004 110.99 160.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 m -67.4 -0.57 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.036 -1.665 . . . . 3.75 114.746 -176.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 mp -63.3 -16.82 61.51 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 120.891 -1.13 . . . . 2.1600000000000001 111.782 165.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.71 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6000000000000001 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 3.3900000000000001 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 1.73 113.884 -166.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.54 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.94999999999999996 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 1.3899999999999999 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81000000000000005 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.55000000000000004 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.2799999999999998 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.1200000000000001 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 3.8100000000000001 112.662 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.601 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 1.8899999999999999 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 1.3400000000000001 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 1.6399999999999999 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 3.3999999999999999 112.632 -176.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 2.0299999999999998 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.59999999999999998 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 3.7400000000000002 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 3.4399999999999999 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 4.1500000000000004 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 1.3500000000000001 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 2.1499999999999999 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6000000000000001 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.9500000000000002 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 2.9700000000000002 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 2.6899999999999999 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.8700000000000001 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 2.1000000000000001 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.9199999999999999 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.69999999999999996 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 3.8500000000000001 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.7799999999999998 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.4199999999999999 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 3.8799999999999999 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 5.6500000000000004 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 1.79 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 3.5800000000000001 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 4.0300000000000002 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.3500000000000001 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.96999999999999997 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt -78.56 -17.13 56.59 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.8399999999999999 112.224 -171.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.2 pp0? -66.94 -16.76 64.55 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.998 2.119 . . . . 1.6599999999999999 113.477 167.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -77.65 -55.1 5.63 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.071 0.949 . . . . 3.1000000000000001 111.062 166.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -115.97 103.24 53.62 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.655 0.782 . . . . 3.6699999999999999 111.563 -166.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.61 -40.82 9.49 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.521 2.814 . . . . 2.6299999999999999 114.227 -164.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -158.61 4.96 0.11 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 122.062 0.934 . . . . 4.8200000000000003 112.986 -167.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.54 5.32 24.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.512 1.301 . . . . 3.7799999999999998 114.512 -139.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.426 1.89 . . . . 5.0 113.327 -158.496 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.255 0.55 . . . . 12.57 111.243 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -70.77 -22.46 62.39 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.964 1.306 . . . . 14.49 113.798 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.8 t -76.01 126.35 30.84 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.669 1.587 . . . . 6.3399999999999999 110.743 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.24 -37.35 3.12 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.036 0.827 . . . . 5.2000000000000002 114.335 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -46.17 -21.25 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 118.919 2.933 . . . . 5.3899999999999997 118.919 -163.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER -135.09 -19.26 1.75 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 120.5 1.5 . . . . 3.7999999999999998 114.853 170.151 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 3.6400000000000001 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 2.4100000000000001 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.8100000000000001 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 5.7599999999999998 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 2.3300000000000001 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 3.5499999999999998 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 6.4400000000000004 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 2.2799999999999998 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.6 -37.95 73.92 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 5.9699999999999998 111.729 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.96 -27.11 73.5 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.673 1.124 . . . . 3.25 113.932 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -68.8 -43.39 75.74 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.003 1.401 . . . . 5.5599999999999996 112.383 164.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -75.58 -53.84 7.97 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.368 1.467 . . . . 3.98 114.698 -171.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.285 23.3 pt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 128.819 2.848 . . . . 6.8499999999999996 115.668 -176.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 112.823 0.675 . . . . 4.4299999999999997 112.823 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.93 -13.64 0.2 Allowed Glycine 0 CA--C 1.546 2.005 0 C-N-CA 125.99 1.757 . . . . 2.5 116.816 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -69.98 165.81 20.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 129.911 3.284 . . . . 2.8399999999999999 115.743 -165.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.8500000000000001 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.3599999999999999 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TRP . . . . . 0.496 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.04 133.35 34.88 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 4.0999999999999996 113.128 -163.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 p 60.51 173.58 0.05 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 127.926 2.49 . . . . 6.5499999999999998 116.693 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -65.51 21.94 0.08 OUTLIER 'Trans proline' 0 CA--C 1.547 1.159 1 C-N-CA 125.375 4.05 . . . . 8.2899999999999991 117.051 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.5 m -82.91 -127.41 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.974 2.11 . . . . 4.2000000000000002 110.155 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -55.53 -34.41 64.65 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 120.801 -1.187 . . . . 2.9199999999999999 110.835 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.73 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.4199999999999999 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 3.3199999999999998 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 1.6399999999999999 113.369 172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.1299999999999999 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.93000000000000005 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.51 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.73999999999999999 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.57999999999999996 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.0800000000000001 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.82999999999999996 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 3.7400000000000002 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.496 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 1.74 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 1.27 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 1.5600000000000001 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 3.29 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 2.4399999999999999 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45000000000000001 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 3.7999999999999998 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 3.6400000000000001 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 3.9300000000000002 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 1.02 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 2.1699999999999999 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.4100000000000001 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.3300000000000001 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 2.6800000000000002 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 3.1299999999999999 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.46 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.51 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.1699999999999999 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.47999999999999998 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 3.5299999999999998 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.8999999999999999 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89000000000000001 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 2.9700000000000002 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.75 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 1.6799999999999999 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 3.5899999999999999 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 5.5999999999999996 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.7400000000000002 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.73999999999999999 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt -73.26 -18.64 61.2 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 3.1600000000000001 111.414 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -53.28 -30.18 37.28 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.566 1.547 . . . . 2.0299999999999998 113.123 165.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -59.83 -27.71 66.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.157 1.783 . . . . 4.25 114.649 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -144.25 123.75 7.27 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 124.234 1.013 . . . . 4.5099999999999998 111.002 -172.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.94 -38.55 0.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 121.947 1.765 . . . . 2.4399999999999999 114.759 -175.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -158.07 60.14 0.46 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 123.12 1.438 . . . . 4.1299999999999999 114.226 -165.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.252 1.0 OUTLIER -134.38 -7.52 2.57 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.273 -1.785 . . . . 2.9100000000000001 112.024 -156.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.924 2.09 . . . . 3.6699999999999999 110.338 -170.207 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 119.345 -0.36 . . . . 17.280000000000001 111.431 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t60 68.83 142.83 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.914 2.486 . . . . 10.33 115.228 -175.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.41 125.22 23.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.33 1.452 . . . . 6.04 112.282 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 8.94 87.09 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 115.442 0.937 . . . . 5.1600000000000001 115.442 175.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -55.22 -48.02 74.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.034 1.333 . . . . 6.1500000000000004 112.9 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt -75.21 -5.34 43.94 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 5.1100000000000003 115.496 -167.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 4.1699999999999999 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.8399999999999999 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 2.0499999999999998 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.8200000000000001 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 5.6699999999999999 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.4800000000000004 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 2.1299999999999999 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 4.75 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 7.0099999999999998 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 2.04 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.1 -41.54 92.75 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 4.7000000000000002 111.282 171.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.31 -33.74 81.88 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.443 1.021 . . . . 2.1800000000000002 114.142 175.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -75.61 -35.99 60.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.454 1.127 . . . . 5.5499999999999998 112.712 172.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -86.0 -19.33 30.53 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.733 1.753 . . . . 5.3799999999999999 115.733 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 8.8 tp . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 114.548 1.314 . . . . 5.4699999999999998 114.548 177.08 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 114.754 1.39 . . . . 3.32 114.754 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.13 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 2.66 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.31 113.382 172.87 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.366 -0.605 . . . . 2.0 109.366 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.24 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.19 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 1.73 112.763 166.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 0.92 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.25 110.799 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.8 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.03 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.98 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.51 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.22 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.71 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 2.64 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 0.92 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.5 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 0.28 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 2.09 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.31 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.47 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.426 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 2.27 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.02 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 2.79 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.06 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 1.4 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.9 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 1.52 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 1.56 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 0.87 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 1.72 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.61 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 1.8 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.15 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.69 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 1.66 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.13 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 0.72 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 2.37 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.03 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.07 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt . . . . . 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.18 111.262 -170.753 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 CA--C 1.55 0.966 0 N-CA-C 113.127 0.788 . . . . 3.83 113.127 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 2.3 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.82 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 1.31 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.22 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 4.19 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 1.51 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 2.92 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 5.95 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 0.97 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 3.26 111.485 171.236 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 N--CA 1.45 -0.441 0 CA-C-O 121.669 0.747 . . . . 3.65 112.615 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.44 112.491 177.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 1.96 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.72 111.269 168.522 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.403 HD23 ' CE2' ' A' ' 23' ' ' PHE . 6.3 mp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 118.787 -0.625 . . . . 1.41 111.76 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.24 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 2.27 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 0.67 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.14 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.67 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 0.88 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.61 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.46 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.94 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.8 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.403 ' CE2' HD23 ' A' ' 11' ' ' LEU . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 2.32 113.209 171.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 0.62 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 0.43 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 0.33 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 2.72 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.06 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.48 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 2.07 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 2.81 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 2.32 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.84 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 1.25 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.06 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.68 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 1.61 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.03 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.0 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.59 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.18 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.61 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 1.72 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 2.03 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 4.31 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 0.72 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 2.98 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 2.98 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.12 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 2.31 112.438 -172.071 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.252 0.6 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 3.08 115.315 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 3.69 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.52 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.11 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.48 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 5.68 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.36 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 1.98 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.08 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 7.95 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 1.43 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 3.4 112.441 173.701 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 122.195 0.998 . . . . 3.87 112.862 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.49 114.481 171.624 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.4 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.632 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.56 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 . . . . . 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.38 114.212 174.384 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.934 1.087 . . . . 1.49 113.934 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.56 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 2.62 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 0.72 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.69 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 0.9 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.25 116.811 175.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.61 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.45 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.11 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.73 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 1.66 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.632 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 0.8 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 0.67 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 0.37 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 2.3 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.38 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 2.4 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 4.88 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 2.61 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.96 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 1.57 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.44 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 1.57 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 2.29 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 0.91 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 1.95 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.63 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.58 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 1.86 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.74 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 1.68 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 4.49 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 0.66 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 4.23 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.47 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.9 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm . . . . . 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 4.05 111.304 -169.775 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 2.75 113.856 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.05 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.08 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 1.25 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 1.57 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 5.19 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.66 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.46 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 3.88 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 5.49 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.04 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.07 111.537 171.174 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.67 120.387 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.44 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 2.21 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 t30 . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 3.5 110.817 -176.001 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 109.552 -0.536 . . . . 2.11 109.552 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 1.91 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.78 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 2.32 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 0.97 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.39 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 1.61 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.76 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 0.91 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.14 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.9 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 2.34 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 0.92 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.52 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 0.38 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 2.07 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.39 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 2.06 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 4.93 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 3.37 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.98 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 1.55 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.24 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 2.09 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 1.87 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.35 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 1.55 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.07 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 1.71 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.07 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.57 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 1.76 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 7.44 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 0.64 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 4.08 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.07 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.33 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp . . . . . 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 3.92 111.403 -170.872 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 2.54 114.001 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 2.65 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 1.39 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 1.89 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 3.99 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 1.75 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 2.58 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 7.72 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.2 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 2.87 112.756 169.465 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 112.726 0.639 . . . . 4.9 112.726 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 2.43 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.499 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.72 113.549 176.266 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 120.607 0.241 . . . . 1.75 110.397 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.26 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 2.01 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 0.69 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.15 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.68 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.03 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.6 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.49 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.66 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.77 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 1.61 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 0.62 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.49 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 0.31 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 2.05 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 1.75 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 2.33 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 2.88 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 2.68 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 0.82 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 1.17 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.93 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.85 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 1.57 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 1.64 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 0.89 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.29 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.53 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 1.84 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.14 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 0.75 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 2.09 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 4.93 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 0.62 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 3.33 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 4.07 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.41 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.72 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt . . . . . 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 2.33 111.781 -170.396 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 3.17 113.685 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 2.26 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.99 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 1.27 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.26 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 3.91 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.68 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.15 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 2.87 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 5.68 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.22 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 3.48 111.161 173.627 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.576 0.954 . . . . 3.72 113.576 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.418 HG21 HD22 ' A' ' 11' ' ' LEU . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.99 110.213 156.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.36 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.31 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.24 115.571 -168.706 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.418 HD22 HG21 ' A' ' 4' ' ' ILE . 2.8 mp . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 118.985 -0.531 . . . . 1.43 111.286 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.23 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 1.91 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 0.73 114.073 -175.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.15 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 0.7 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.09 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.57 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.48 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 0.74 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 1.65 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.598 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 0.62 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.52 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 0.37 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 2.87 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 1.94 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.42 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 2.38 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 4.01 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 2.45 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 0.82 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.17 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 1.71 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 1.68 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 0.9 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 1.81 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.15 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.44 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 1.96 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.36 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 1.73 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 4.56 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 0.57 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 2.82 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 3.76 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.4 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 2.09 111.398 -167.903 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 113.746 1.017 . . . . 2.8 113.746 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 2.32 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.93 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 1.29 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 1.43 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 5.81 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.28 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 1.94 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 2.62 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 6.13 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 0.99 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt . . . . . 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.03 110.548 171.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 114.773 1.398 . . . . 3.72 114.773 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.38 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.01 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 . . . . . 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.85 114.275 170.173 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 113.605 0.965 . . . . 1.28 113.605 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.59 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 2.14 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 0.75 113.783 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.13 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.06 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.37 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.56 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.48 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 0.85 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 1.6 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 0.62 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 0.75 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 0.34 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 1.97 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.19 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.42 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 2.15 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 3.62 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 2.63 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.79 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.09 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 40' ' ' SER . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 2.6 109.239 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 1.78 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 0.89 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.432 ' HB3' ' HB ' ' A' ' 37' ' ' ILE . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.35 114.949 172.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.63 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.59 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 2.42 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.33 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.67 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 2.22 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 3.77 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 0.56 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.02 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.12 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.74 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt . . . . . 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 2.36 112.403 -167.033 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 2.73 113.311 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 2.03 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.68 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 1.13 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.27 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 3.52 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.41 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.11 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 2.99 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 6.6 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 0.9 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 4.17 111.754 167.443 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 114.267 1.21 . . . . 3.46 114.267 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.68 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 2.91 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.55 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.34 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.41 111.281 172.093 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 117.559 -1.21 . . . . 1.84 112.428 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.55 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.64 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 2.25 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 0.74 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.89 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 1.16 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.58 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.29 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.64 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.81 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.34 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 1.74 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.55 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 0.7 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 0.55 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 0.49 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 2.12 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.35 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 2.24 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 4.39 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 2.71 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.96 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 1.57 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.94 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.01 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 2.68 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.16 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 1.98 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.36 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.66 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 1.77 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.22 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.59 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 2.44 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 4.83 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 0.59 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 2.9 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 2.95 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.64 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 2.55 111.332 -176.232 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 118.902 -0.571 . . . . 2.55 112.218 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 2.49 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.82 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 1.82 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' HIS . . . . . 0.441 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.24 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 4.84 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.11 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 1.85 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 6.55 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 5.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.75 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 3.14 111.525 176.167 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 122.696 1.236 . . . . 2.88 112.995 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.454 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.44 110.374 165.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 2.45 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.514 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.43 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.65 114.222 -171.813 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 110.232 -0.284 . . . . 2.42 110.232 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.56 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 2.54 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.582 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 0.75 113.709 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.36 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 0.83 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.05 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.57 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.89 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 0.95 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 2.02 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.582 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 0.74 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.55 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 0.29 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 1.97 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 1.77 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.47 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 2.09 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 3.54 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 2.9 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.97 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 1.45 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.49 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.36 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.05 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 2.22 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 0.87 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.28 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.45 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 1.91 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.92 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.55 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 1.73 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 3.67 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 0.48 113.604 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 2.3 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 3.76 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.69 115.592 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.69 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 2.29 111.014 -167.312 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.311 2.5 pt? . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 2.8 114.413 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 2.36 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.61 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 1.73 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.37 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 3.47 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.95 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 2.77 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.06 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 6.76 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 1.58 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 3.8 110.145 168.554 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 114.041 1.126 . . . . 3.43 114.041 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.442 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.12 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.561 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.87 113.588 -170.202 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 1.5 112.365 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.04 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.34 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 2.18 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 0.65 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.19 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 0.88 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 1.54 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.76 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.71 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.11 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.81 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 1.68 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 0.55 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.44 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 0.38 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 2.01 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 1.73 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.4 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 2.31 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 2.87 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 2.85 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.73 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 1.36 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.01 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 1.81 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 1.86 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 1.79 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.53 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.42 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 1.7 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.47 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.97 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 1.74 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 5.31 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 0.62 113.626 171.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 2.05 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.18 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp . . . . . 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 3.53 110.722 -167.767 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 2.85 114.943 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 1.92 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.44 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 1.32 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 1.43 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 4.95 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.73 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.05 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 3.69 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 7.98 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 1.43 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 3.57 111.172 171.648 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 113.274 0.842 . . . . 4.52 113.274 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.53 111.937 172.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.01 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 118.018 -0.991 . . . . 1.79 113.406 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.33 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 4.09 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 1.07 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.86 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.11 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.31 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.09 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.29 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.12 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.06 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 1.93 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 0.97 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 0.79 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 0.31 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 2.07 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 1.41 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.58 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 2.24 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 2.76 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 3.02 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 1.79 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.78 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.61 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 1.71 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 1.66 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 42' ' ' CYS . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.03 115.808 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.37 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.37 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.403 ' HB2' ' HA2' ' A' ' 39' ' ' GLY . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.53 114.561 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 1.81 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.24 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.69 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 1.89 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 5.51 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 0.89 113.351 167.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 3.53 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 3.89 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.9 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp . . . . . 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 4.72 111.269 -170.607 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 3.62 114.281 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 3.8 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.36 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 2.35 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 2.98 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.0 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.72 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 1.68 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 3.8 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 7.08 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 1.75 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 4.05 110.771 171.976 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.26 114.46 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.57 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.55 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 3.09 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CE3' HG21 ' A' ' 4' ' ' ILE . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.69 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.68 113.567 174.745 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.45 HD22 ' CG2' ' A' ' 4' ' ' ILE . 8.0 mp . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.544 0.572 . . . . 1.34 112.544 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 2.63 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 0.84 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.34 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 0.86 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.24 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.76 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.69 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.09 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.12 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 1.89 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 0.84 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 0.85 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 0.31 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 2.78 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 1.78 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.43 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 1.95 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 3.43 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 2.46 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.61 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 1.25 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.88 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 1.77 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 1.57 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.36 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.91 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.18 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.51 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 1.46 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.84 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.74 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 2.02 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 4.41 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 0.71 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 2.59 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 3.58 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.67 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.97 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt . . . . . 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.06 111.832 -168.227 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 2.42 115.009 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 2.63 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.08 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 1.69 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.24 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 4.71 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.02 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 2.39 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 4.04 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 6.46 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.29 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 4.35 111.756 170.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 . . . . . 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.46 116.694 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.32 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.14 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.31 113.426 -176.056 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 114.301 1.223 . . . . 1.73 114.301 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.41 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.64 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 2.02 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 0.79 115.095 -167.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.24 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.72 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 0.96 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.51 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.82 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.68 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.414 ' HD2' ' HB2' ' A' ' 15' ' ' ALA . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 1.79 112.854 169.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 0.85 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.56 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 0.33 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 2.02 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 1.87 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.42 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.436 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 2.7 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.06 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 2.44 113.339 162.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.61 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 1.09 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.26 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.67 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 3.63 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 2.82 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.39 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.45 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.47 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.54 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 1.5 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.9 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 2.02 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 3.73 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 0.55 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 2.44 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.16 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.55 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 2.3 111.933 -168.503 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 118.174 -0.917 . . . . 2.84 110.872 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 2.94 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.14 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 1.35 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.19 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 4.54 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.94 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.0 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 3.31 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 7.77 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 1.06 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 3.33 110.621 174.969 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 116.396 1.999 . . . . 4.88 116.396 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.56 111.815 170.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.09 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.35 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.17 113.301 175.743 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 109.905 -0.406 . . . . 1.95 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.53 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.28 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 2.26 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.36 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.36 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.15 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 1.49 115.635 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.16 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 0.96 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.39 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.15 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 1.57 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 0.6 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.47 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 0.35 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 2.18 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.38 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.48 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 3.56 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 3.63 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 2.78 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.77 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 1.25 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.83 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 2.67 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 2.47 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.25 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.51 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.41 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 1.47 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.08 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 1.77 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 3.52 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 0.53 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 2.38 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 3.22 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.91 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm . . . . . 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 4.5 111.839 -169.634 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 4.66 115.285 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 2.55 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.26 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 1.36 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 1.69 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 4.53 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.37 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 1.92 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 3.4 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 5.41 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 0.97 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 3.86 110.85 174.824 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 122.324 1.059 . . . . 3.23 112.284 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.55 111.105 177.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 3.46 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.607 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.59 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 . . . . . 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.51 115.389 -151.325 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.539 HD23 ' CE2' ' A' ' 23' ' ' PHE . 8.7 mp . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.06 1.133 . . . . 1.88 114.06 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.32 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.9 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.408 ' HG2' ' CZ ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 2.48 114.782 -175.351 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.17 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.82 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.35 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 1.6 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 0.97 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.63 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.539 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 2.14 112.357 168.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 0.89 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.61 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 0.39 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.407 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 2.11 113.151 -178.358 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 1.74 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 2.41 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 2.79 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 2.55 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.93 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 1.45 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.95 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.08 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 1.62 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 1.68 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 1.44 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.68 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.11 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.53 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 1.48 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.33 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.64 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 1.84 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 4.15 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 0.96 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 3.52 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 3.69 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.51 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 1.99 111.923 -169.967 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.968 1.099 . . . . 3.59 113.968 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 3.11 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.32 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 1.68 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 2.77 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.22 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.03 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.25 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 3.37 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 9.26 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 1.93 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt . . . . . 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 3.8 111.563 176.354 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 122.219 1.009 . . . . 3.1 113.502 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.531 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.11 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.554 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.34 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.31 112.442 168.72 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 118.657 -0.687 . . . . 1.26 112.341 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.14 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.41 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.466 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.39 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 0.93 113.445 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.08 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.7 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.03 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.69 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.83 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 0.7 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.466 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 1.61 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 0.67 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 0.71 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 0.32 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 2.1 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.32 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.41 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 2.7 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 2.72 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 2.25 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.66 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 1.13 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.53 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.94 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 2.15 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 1.76 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.29 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 1.51 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.76 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.64 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 1.35 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.82 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.58 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 1.69 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 3.91 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 0.56 112.231 172.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 2.59 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.25 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.71 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.05 112.229 -168.24 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.229 -0.891 . . . . 2.51 113.361 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 2.36 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.5 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 1.48 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 1.37 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 4.5 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.56 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 1.66 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 2.61 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 5.27 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 0.89 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 3.29 111.892 177.213 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.007 1.114 . . . . 2.97 114.007 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.469 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.95 112.803 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.46 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.485 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.29 113.008 167.677 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 110.553 -0.166 . . . . 2.34 110.553 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.63 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 1.76 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.501 ' HB1' ' CE ' ' A' ' 24' ' ' LYS 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 0.9 114.814 -172.615 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.29 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 0.8 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.38 114.525 166.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.61 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.81 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 0.82 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 1.95 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.501 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 0.58 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.49 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 0.31 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 1.97 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.35 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.41 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 2.69 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 2.71 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 2.4 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.67 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 1.09 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.62 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.85 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 1.9 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 1.81 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.37 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.44 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.97 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.7 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 2.11 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.12 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 1.72 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 5.64 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 0.63 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 2.33 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.05 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.06 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.69 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.0 112.078 -168.864 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 113.272 0.841 . . . . 3.06 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 1.8 114.833 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 1.25 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.24 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 5.22 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.47 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 1.53 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 3.39 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 5.48 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.09 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 4.13 112.13 174.072 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 CA--C 1.542 0.665 0 N-CA-C 113.447 0.906 . . . . 3.75 113.447 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.01 110.334 162.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.09 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.533 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.31 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.05 110.183 -174.204 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.666 -0.124 . . . . 1.83 110.666 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.32 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.36 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 1.75 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 0.73 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 0.74 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 1.47 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.64 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.48 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.03 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.79 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 2.3 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 1.09 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.5 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 0.33 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 2.14 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.24 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 2.35 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 2.62 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 2.16 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.16 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 1.36 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.14 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.32 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 1.84 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 1.95 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.28 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.53 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.6 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 1.93 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.57 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.59 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 2.1 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 3.56 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 0.51 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 2.6 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 3.17 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.43 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp . . . . . 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 3.23 111.655 -170.015 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 3.42 114.209 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 2.53 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.92 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 1.26 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.31 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 3.48 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.76 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 1.91 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 2.61 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 4.73 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 0.94 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.01 110.439 167.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 . . . . . 0 CA--C 1.551 0.999 0 N-CA-C 113.395 0.887 . . . . 3.55 113.395 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 11' ' ' LEU . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.91 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.47 115.113 -169.331 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 4' ' ' ILE . 4.5 mp . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 118.403 -0.808 . . . . 1.23 111.782 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.49 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 2.26 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 0.69 113.884 -166.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.38 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.73 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 0.95 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.44 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.28 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.06 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.617 ' CE2' HD23 ' A' ' 11' ' ' LEU . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 2.27 112.662 172.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 0.65 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 0.88 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 0.33 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.419 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 2.06 112.632 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 1.53 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.6 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 2.39 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 2.56 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 2.81 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 0.89 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 1.33 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.95 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 1.63 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 1.81 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.5 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 1.71 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.92 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.7 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 2.56 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.78 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.07 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 2.36 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 4.32 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 0.9 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 2.78 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 3.29 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.35 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.97 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt . . . . . 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.04 112.224 -171.102 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 114.853 1.427 . . . . 2.73 114.853 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 2.5 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.01 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 1.56 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 44.1 m170 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.32 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 4.94 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 1.63 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 2.86 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 5.25 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 1.28 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 4.76 111.729 179.353 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 115.743 1.757 . . . . 2.84 115.743 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.85 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.36 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 2.88 113.128 -163.778 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 CA--C 1.546 0.795 0 CA-C-O 119.511 -0.28 . . . . 1.69 110.835 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.38 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.24 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 2.07 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 0.9 113.369 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.11 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.7 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.03 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.74 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.47 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.08 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.68 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 2.2 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 0.72 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 0.72 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 0.31 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 1.98 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 1.57 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 2.45 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 2.76 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 2.59 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 0.81 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 1.25 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.41 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.33 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 1.86 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 2.06 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.14 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.33 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.17 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.43 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 2.16 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.9 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 1.78 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.03 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 0.69 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 2.66 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 4.67 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.74 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.74 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt . . . . . 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 2.48 111.414 -169.635 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 3.86 115.496 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 3.13 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.84 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 1.3 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.27 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 4.9 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.48 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 1.69 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 3.76 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 5.94 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 1.33 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 3.69 111.282 171.915 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.917 -0.563 . . . . 5.45 111.768 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.08 24.07 30.57 Favored Glycine 0 CA--C 1.538 1.52 0 C-N-CA 124.335 0.969 . . . . 2.19 114.494 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.33 165.79 23.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.821 2.048 . . . . 3.32 114.754 -173.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.13 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 2.66 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -74.37 -14.23 60.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.31 113.382 172.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.4 m -54.08 127.27 54.5 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 125.297 1.439 . . . . 5.23 112.514 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -58.06 139.13 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.94 2.426 . . . . 4.4 114.782 -172.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m 65.49 -33.58 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.922 2.489 . . . . 5.82 115.901 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt -60.83 -46.2 91.5 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.355 1.434 . . . . 2.0 109.366 159.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.24 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.19 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 1.73 112.763 166.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 0.92 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.25 110.799 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.8 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.03 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.98 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.51 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.22 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.71 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 2.64 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 0.92 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.5 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 0.28 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 2.09 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.31 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.47 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.426 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 2.27 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.02 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 2.79 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.06 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 1.4 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.9 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 1.52 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 1.56 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 0.87 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 1.72 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.61 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 1.8 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.15 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.69 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 1.66 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.13 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 0.72 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 2.37 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.03 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.07 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt -80.91 -20.0 43.1 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.18 111.262 -170.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -66.09 -19.85 65.98 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.903 1.681 . . . . 2.19 112.487 172.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -79.53 -27.08 41.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.861 1.265 . . . . 3.42 113.853 168.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -132.83 102.65 13.44 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 123.499 0.719 . . . . 2.74 112.87 -164.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.18 -50.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.447 2.098 . . . . 2.65 112.444 -173.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -159.23 54.67 0.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 123.92 1.819 . . . . 4.71 111.439 -169.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 59' ' ' LEU . 0.6 OUTLIER -109.24 -10.17 14.97 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 128.413 2.685 . . . . 1.92 111.996 -155.549 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 15.6 p90 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.232 2.613 . . . . 2.8 111.945 -165.36 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 112.151 0.426 . . . . 12.22 112.151 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -68.09 166.78 15.34 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.526 1.53 . . . . 9.76 112.713 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.2 t -95.69 127.67 41.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 5.12 111.546 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.33 72.76 0.98 Allowed Glycine 0 CA--C 1.534 1.26 0 N-CA-C 115.698 1.039 . . . . 3.65 115.698 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -76.5 -16.5 59.63 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.617 1.34 . . . . 7.26 114.617 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt -109.09 -0.99 19.15 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.126 1.77 . . . . 3.83 113.127 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 2.3 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.82 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 1.31 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.22 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 4.19 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 1.51 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 2.92 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 5.95 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 0.97 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.5 -36.55 79.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 3.26 111.485 171.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.41 -32.71 61.04 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.707 1.622 . . . . 1.75 114.041 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -84.86 -37.43 20.68 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.732 1.266 . . . . 5.31 113.484 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -80.54 -33.61 36.12 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.915 1.45 . . . . 3.61 114.915 -169.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.94 1.296 . . . . 5.02 111.25 -178.124 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 118.565 -0.731 . . . . 3.92 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.48 27.69 70.89 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-N 119.87 1.214 . . . . 2.24 113.401 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -72.58 162.01 30.03 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.563 2.345 . . . . 3.65 112.615 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.44 112.491 177.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 1.96 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -57.51 142.69 43.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.72 111.269 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.5 m 58.68 160.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 127.101 2.161 . . . . 5.21 114.964 -175.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -75.2 22.38 0.43 Allowed 'Trans proline' 0 CA--C 1.547 1.134 0 N-CA-C 118.73 2.55 . . . . 4.9 118.73 -154.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.15 -60.31 2.3 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.751 1.16 . . . . 4.34 112.868 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.403 HD23 ' CE2' ' A' ' 23' ' ' PHE . 6.3 mp -110.24 -13.63 14.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.298 1.039 . . . . 1.41 111.76 166.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.24 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 2.27 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 0.67 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.14 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.67 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 0.88 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.61 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.46 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.94 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.8 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.403 ' CE2' HD23 ' A' ' 11' ' ' LEU . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 2.32 113.209 171.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 0.62 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 0.43 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 0.33 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 2.72 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.06 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.48 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 2.07 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 2.81 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 2.32 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.84 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 1.25 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.06 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.68 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 1.61 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.03 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.0 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.59 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.18 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.61 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 1.72 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 2.03 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 4.31 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 0.72 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 2.98 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 2.98 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.12 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.87 -8.82 58.63 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 2.31 112.438 -172.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -71.46 -23.75 61.89 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.938 1.695 . . . . 2.23 112.751 163.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -70.93 -48.65 52.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.13 0.972 . . . . 3.26 110.98 169.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.445 ' HB3' ' CG ' ' A' ' 59' ' ' LEU . 8.4 m-85 -127.28 95.68 35.59 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 125.993 1.717 . . . . 2.44 109.334 -168.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -76.53 -35.29 2.18 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 124.026 3.15 . . . . 4.01 115.06 -161.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -149.62 -2.52 0.42 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.578 1.151 . . . . 6.06 113.194 -166.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.445 ' CG ' ' HB3' ' A' ' 56' ' ' TYR . 0.2 OUTLIER -85.73 12.09 9.67 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 115.208 1.559 . . . . 3.33 115.208 -142.065 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.428 0 C-N-CA 127.487 2.315 . . . . 3.56 114.595 -157.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.949 -0.389 . . . . 11.67 109.949 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -67.96 161.94 25.45 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.522 0.564 . . . . 10.08 112.522 -178.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 66.09 -39.06 0.31 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.936 2.094 . . . . 4.73 114.407 -175.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.68 14.99 0.68 Allowed Glycine 0 CA--C 1.535 1.31 0 N-CA-C 118.632 2.213 . . . . 4.09 118.632 -167.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -50.54 -30.92 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 121.232 2.516 . . . . 6.17 114.99 178.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.75 ' H ' HD23 ' B' ' 66' ' ' LEU 0.252 0.6 OUTLIER -79.93 -19.9 46.94 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 3.08 115.315 176.489 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 3.69 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.52 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.11 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.48 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 5.68 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.36 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 1.98 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.08 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 7.95 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 1.43 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt -63.47 -39.35 94.24 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 3.4 112.441 173.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 -44.42 88.43 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.076 0.846 . . . . 2.18 112.803 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -72.14 -27.47 62.63 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.53 0.937 . . . . 6.32 113.53 171.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -68.58 -50.52 51.08 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.966 1.307 . . . . 3.79 112.79 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 C--O 1.254 1.33 0 C-N-CA 124.624 1.17 . . . . 4.65 112.653 -168.91 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 117.767 -1.111 . . . . 7.23 111.915 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.83 15.39 41.7 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 120.254 1.388 . . . . 5.79 115.757 -173.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -76.97 162.54 27.49 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.756 1.278 . . . . 3.87 112.862 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.49 114.481 171.624 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.4 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.632 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.56 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.32 -20.24 64.73 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.38 114.212 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 91.4 p -66.31 146.67 99.05 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 121.316 -0.865 . . . . 4.76 111.628 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -62.88 -8.93 14.84 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.242 2.628 . . . . 4.49 113.135 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.3 m -58.59 -51.93 67.81 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.748 2.019 . . . . 5.14 112.432 171.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.87 -15.14 13.42 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.298 1.439 . . . . 1.49 113.934 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.56 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 2.62 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 0.72 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.69 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 0.9 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.25 116.811 175.323 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.61 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.45 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.11 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.73 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 1.66 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.632 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 0.8 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 0.67 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 0.37 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 2.3 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.38 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 2.4 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 4.88 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 2.61 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.96 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 1.57 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.44 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 1.57 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 2.29 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 0.91 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 1.95 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.63 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.58 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 1.86 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.74 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 1.68 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 4.49 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 0.66 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 4.23 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.47 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.9 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm -73.17 -21.16 60.75 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 4.05 111.304 -169.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -56.49 -18.83 12.75 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.312 1.445 . . . . 2.25 113.733 165.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -62.78 -34.83 78.06 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.759 1.623 . . . . 3.56 113.86 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -144.29 127.82 8.84 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.189 0.996 . . . . 2.88 111.238 -167.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -81.24 -45.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 121.552 1.501 . . . . 2.59 115.245 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -160.16 64.99 0.34 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 122.992 1.377 . . . . 4.33 110.848 -161.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.282 0.4 OUTLIER -135.9 -14.01 1.87 Allowed 'General case' 0 CA--C 1.561 1.369 0 CA-C-N 113.017 -1.901 . . . . 2.08 112.012 -160.153 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 2.5 p90 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.033 1.733 . . . . 3.43 115.235 -162.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' B' ' 62' ' ' HIS . 0.7 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 111.236 0.087 . . . . 17.5 111.236 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' HIS . . . . . 0.41 ' H ' ' CD ' ' B' ' 61' ' ' GLU . 79.5 m80 -83.5 -178.89 7.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.16 2.184 . . . . 13.28 113.277 -177.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.59 155.14 12.92 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.949 -1.094 . . . . 7.5 111.853 165.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.44 -50.6 4.08 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.507 1.051 . . . . 3.13 111.189 -165.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -82.44 -40.66 20.87 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.537 0.94 . . . . 5.53 113.537 176.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.43 -30.09 68.23 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 2.75 113.856 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.05 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.08 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 1.25 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 1.57 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 5.19 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.66 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.46 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 3.88 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 5.49 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.04 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt -62.09 -48.91 78.06 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.07 111.537 171.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.66 -30.99 69.99 Favored Glycine 0 CA--C 1.537 1.469 0 O-C-N 120.978 -1.077 . . . . 2.5 114.252 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -74.86 -34.23 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.967 2.107 . . . . 4.16 113.188 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtt -68.5 -38.36 80.89 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 117.75 -1.119 . . . . 3.68 112.799 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.489 1.499 0 C-N-CA 124.493 1.117 . . . . 5.63 113.925 179.057 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 7.5 p30 . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.975 1.102 . . . . 5.54 113.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.5 -32.65 6.96 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.806 1.193 . . . . 3.26 113.142 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.09 -3.9 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.67 120.387 153.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.44 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 2.21 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -103.35 165.98 10.71 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 3.5 110.817 -176.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.426 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 32.5 t 68.77 147.08 0.11 Allowed Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.63 2.772 . . . . 5.16 113.337 -166.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 43.2 Cg_exo -68.55 19.15 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 124.031 3.154 . . . . 5.29 117.075 -171.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 m -101.84 -101.17 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.026 1.331 . . . . 3.15 109.773 -170.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt -57.85 -40.8 81.01 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.147 -0.971 . . . . 2.11 109.552 166.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 1.91 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.78 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 2.32 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 0.97 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.39 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 1.61 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.76 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 0.91 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.14 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.9 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 2.34 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 0.92 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.52 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 0.38 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 2.07 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.39 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 2.06 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 4.93 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 3.37 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.98 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 1.55 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.24 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 2.09 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 1.87 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.35 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 1.55 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.07 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 1.71 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.07 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.57 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 1.76 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 7.44 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 0.64 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 4.08 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.07 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.33 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp -83.72 -19.82 34.54 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 3.92 111.403 -170.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -69.19 -5.22 21.22 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.18 1.392 . . . . 2.48 113.729 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -79.16 -29.89 43.25 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.278 1.214 . . . . 3.92 114.278 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.404 ' CB ' HD12 ' A' ' 59' ' ' LEU . 6.3 m-85 -121.66 130.6 24.7 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 118.794 0.725 . . . . 3.02 112.838 -165.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -89.1 -28.04 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.942 2.428 . . . . 4.76 113.564 171.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -161.69 -0.8 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.824 1.416 . . . . 7.77 114.824 -156.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' N ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -70.28 -17.72 63.1 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.668 1.987 . . . . 3.97 112.975 -165.182 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.428 ' N ' HD13 ' A' ' 59' ' ' LEU . 43.2 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 128.893 2.877 . . . . 4.95 113.382 -167.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.91 -0.09 . . . . 11.12 110.872 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -110.66 148.19 32.75 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.654 1.182 . . . . 8.84 112.288 172.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -11.86 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.119 1.367 . . . . 4.55 114.137 172.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.3 174.1 50.15 Favored Glycine 0 CA--C 1.534 1.265 0 O-C-N 121.224 -0.923 . . . . 3.96 115.066 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -66.01 -37.96 87.24 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.152 1.381 . . . . 7.07 113.49 -170.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -54.21 -42.86 70.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 2.54 114.001 -168.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 2.65 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 1.39 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 1.89 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 3.99 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 1.75 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 2.58 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 7.72 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.2 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp -64.59 -30.9 71.93 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 2.87 112.756 169.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.14 -43.26 98.53 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.598 1.57 . . . . 2.56 113.078 170.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -72.61 -42.29 64.64 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.527 -0.984 . . . . 5.2 113.429 171.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -70.3 -40.41 74.27 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.98 1.312 . . . . 4.5 113.751 -173.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 31.2 mm . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 116.92 -1.514 . . . . 4.08 112.677 -168.312 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.0 t30 . . . . . 0 N--CA 1.477 0.918 0 CA-C-O 118.594 -0.717 . . . . 5.65 112.76 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.8 21.85 78.85 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 121.02 1.736 . . . . 3.13 113.793 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -109.86 -34.02 6.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.394 1.878 . . . . 4.9 112.726 -171.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 2.43 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.499 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -65.92 -30.42 71.0 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.72 113.549 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -63.91 128.69 93.23 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 124.685 1.194 . . . . 4.87 110.885 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.83 -18.82 18.87 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.515 2.143 . . . . 4.4 116.433 -152.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -94.37 -51.78 4.64 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.666 1.121 . . . . 4.52 111.487 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -60.71 -41.48 95.34 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.271 -0.893 . . . . 1.75 110.397 171.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.26 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 2.01 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 0.69 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.15 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.68 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.03 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.6 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.49 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.66 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.77 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 1.61 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 0.62 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.49 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 0.31 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 2.05 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 1.75 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 2.33 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 2.88 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 2.68 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 0.82 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 1.17 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.93 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.85 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 1.57 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 1.64 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 0.89 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.29 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.53 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 1.84 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.14 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 0.75 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 2.09 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 4.93 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 0.62 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 3.33 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 4.07 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.41 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.72 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt -88.22 -15.78 35.0 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 2.33 111.781 -170.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -60.13 -20.98 60.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.758 1.223 . . . . 1.57 112.459 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -76.12 -33.43 59.44 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.525 1.13 . . . . 2.89 113.283 168.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -135.1 108.62 10.51 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.794 1.035 . . . . 2.41 113.794 -161.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.56 -50.98 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.686 2.257 . . . . 2.32 113.609 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -159.62 62.55 0.37 Allowed 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 124.293 1.996 . . . . 4.77 110.659 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 59' ' ' LEU 0.27 0.4 OUTLIER -106.34 -9.14 16.9 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 112.622 -2.081 . . . . 1.9 111.719 -157.982 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 17.7 p90 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 128.141 2.576 . . . . 2.8 111.984 -165.252 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.323 -0.621 . . . . 14.23 109.323 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 59.56 25.7 14.6 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.569 1.692 . . . . 10.75 115.569 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 t -98.98 144.83 27.69 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.095 1.358 . . . . 4.98 110.576 167.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.25 134.42 52.41 Favored Glycine 0 CA--C 1.536 1.355 0 N-CA-C 115.247 0.859 . . . . 2.91 115.247 -164.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.76 -15.71 13.42 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.085 1.354 . . . . 7.28 114.171 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -59.66 -29.24 67.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 3.17 113.685 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 2.26 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.99 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 1.27 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.26 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 3.91 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.68 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.15 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 2.87 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 5.68 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.22 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.11 -50.64 72.8 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 3.48 111.161 173.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.38 -28.68 69.81 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-N 118.934 0.788 . . . . 1.99 114.202 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -79.65 -25.7 41.29 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.122 1.369 . . . . 4.14 113.476 170.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -85.9 -59.12 2.39 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.748 1.619 . . . . 3.84 113.788 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 9.1 pt . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 114.6 1.333 . . . . 5.29 114.6 -160.83 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 118.456 -0.783 . . . . 6.26 110.993 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.66 6.45 66.71 Favored Glycine 0 CA--C 1.541 1.711 0 N-CA-C 116.553 1.381 . . . . 4.14 116.553 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -85.47 -179.95 7.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.844 1.658 . . . . 3.72 113.576 -172.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.418 HG21 HD22 ' A' ' 11' ' ' LEU . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.99 110.213 156.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.36 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.31 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -130.5 -40.92 1.23 Allowed 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.24 115.571 -168.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.9 m -81.19 -45.93 1.15 Allowed Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 119.916 1.235 . . . . 5.26 114.265 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -81.38 173.61 11.42 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.724 2.282 . . . . 7.51 112.631 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -77.09 19.04 0.33 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.984 1.846 . . . . 3.92 115.984 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.418 HD22 HG21 ' A' ' 4' ' ' ILE . 2.8 mp -78.42 -6.63 55.84 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.892 -1.13 . . . . 1.43 111.286 157.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.23 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 1.91 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 0.73 114.073 -175.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.15 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 0.7 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.09 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.57 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.48 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 0.74 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 1.65 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.598 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 0.62 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.52 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 0.37 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 2.87 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 1.94 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.42 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 2.38 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 4.01 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 2.45 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 0.82 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.17 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 1.71 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 1.68 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 0.9 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 1.81 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.15 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.44 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 1.96 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.36 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 1.73 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 4.56 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 0.57 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 2.82 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 3.76 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.4 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt -76.62 -19.67 57.56 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 2.09 111.398 -167.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -55.58 -26.8 45.61 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.692 1.597 . . . . 1.69 113.328 170.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -61.0 -32.39 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.14 1.533 . . . . 3.84 115.14 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -144.32 126.6 8.32 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.727 1.01 . . . . 2.24 113.727 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -94.37 -38.98 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 122.674 2.25 . . . . 2.37 115.46 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -152.98 76.73 1.14 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.169 1.461 . . . . 4.46 109.913 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.261 0.2 OUTLIER -144.84 -8.4 0.63 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 113.463 -1.699 . . . . 2.01 111.132 -163.219 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.775 2.43 . . . . 2.5 113.584 -164.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.092 -0.336 . . . . 13.6 110.092 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.8 p80 -145.13 173.05 12.25 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.793 0.837 . . . . 8.56 111.848 166.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 128.93 38.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.777 -0.577 . . . . 4.4 109.584 175.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.63 173.39 37.47 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.562 1.077 . . . . 3.19 115.384 -170.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -78.52 -5.9 53.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.263 1.425 . . . . 6.04 113.824 -173.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.51 ' H ' HD23 ' B' ' 66' ' ' LEU . 1.8 pt? -63.81 -34.75 78.61 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.337 1.055 . . . . 2.8 113.746 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 2.32 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.93 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 1.29 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 1.43 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 5.81 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.28 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 1.94 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 2.62 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 6.13 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 0.99 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt -61.88 -43.26 99.21 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.03 110.548 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.98 -43.83 92.96 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.546 0.612 . . . . 1.87 113.563 172.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -67.99 -31.89 71.92 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.876 1.671 . . . . 4.08 113.845 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -80.71 -49.38 11.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.494 1.518 . . . . 3.37 113.327 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.7 mm . . . . . 0 C--O 1.253 1.288 0 C-N-CA 125.333 1.453 . . . . 4.94 113.381 -165.818 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.996 -0.526 . . . . 4.86 111.491 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.18 15.99 32.15 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.051 1.31 . . . . 2.64 115.681 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -82.41 164.4 21.03 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.174 1.487 . . . . 3.72 114.773 -165.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.38 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.01 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 53.1 -138.86 1.08 Allowed 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.85 114.275 170.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.2 t -99.3 -58.78 0.13 Allowed Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 126.679 1.992 . . . . 7.41 113.928 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -79.8 -179.83 5.65 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.92 2.413 . . . . 4.33 111.857 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.5 m 58.25 -108.58 0.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.255 1.422 . . . . 3.69 112.069 175.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -75.95 -11.88 60.04 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.382 0.992 . . . . 1.28 113.605 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.59 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 2.14 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 0.75 113.783 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.13 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.06 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.37 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.56 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.48 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 0.85 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 1.6 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 0.62 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 0.75 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 0.34 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 1.97 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.19 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.42 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 2.15 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 3.62 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 2.63 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.79 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.09 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 40' ' ' SER . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 2.6 109.239 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 1.78 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 0.89 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.432 ' HB3' ' HB ' ' A' ' 37' ' ' ILE . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.35 114.949 172.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.63 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.59 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 2.42 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.33 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.67 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 2.22 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 3.77 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 0.56 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.02 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.12 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.74 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt -78.87 -19.39 52.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 2.36 112.403 -167.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -62.37 -19.19 63.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.836 2.055 . . . . 1.83 113.504 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -69.65 -51.3 36.05 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.172 1.389 . . . . 2.83 112.299 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -113.13 122.58 35.38 Favored Pre-proline 0 N--CA 1.468 0.472 0 C-N-CA 123.374 0.67 . . . . 2.08 111.526 -168.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -85.54 -26.11 1.42 Allowed 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.166 2.578 . . . . 2.33 113.391 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.56 -0.05 0.11 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.075 1.139 . . . . 4.12 114.075 -158.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.403 HD13 ' C ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -76.55 -8.94 58.21 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.616 1.966 . . . . 1.99 111.445 -167.657 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.935 0 C-N-CA 131.143 3.777 . . . . 2.95 111.436 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.586 0.232 . . . . 10.89 111.19 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -73.66 -25.96 60.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.015 1.726 . . . . 8.69 114.152 -176.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.3 t -123.1 133.31 54.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.004 1.722 . . . . 4.11 111.965 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.4 -18.86 0.02 OUTLIER Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.554 1.382 . . . . 3.38 116.554 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -57.23 -49.9 74.59 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.053 1.926 . . . . 5.45 112.911 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.32 -29.41 66.12 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 2.73 113.311 171.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 2.03 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.68 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 1.13 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.27 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 3.52 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.41 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.11 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 2.99 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 6.6 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 0.9 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt -70.07 -44.29 69.4 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 4.17 111.754 167.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.22 -27.68 60.59 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 119.735 1.152 . . . . 2.16 114.326 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -76.63 -47.67 21.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.322 1.849 . . . . 4.16 112.1 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -71.76 -29.45 64.51 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.733 1.613 . . . . 3.67 115.318 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 12.2 tt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 126.293 1.837 . . . . 4.74 113.205 -174.618 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.0 t30 . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 119.642 -0.218 . . . . 4.25 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.47 -8.7 26.37 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 126.067 1.794 . . . . 2.33 114.942 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -80.24 155.53 27.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.253 1.421 . . . . 3.46 114.267 -173.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.68 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 2.91 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.55 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.34 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.48 143.19 46.49 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.41 111.281 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t 62.61 150.57 0.1 Allowed Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 128.229 2.611 . . . . 5.48 113.046 -163.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -62.91 -0.44 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.217 2.612 . . . . 6.35 117.46 -169.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.4 m -53.65 -58.3 7.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.697 1.999 . . . . 4.59 113.458 -169.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp -95.03 -17.48 21.87 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.234 1.414 . . . . 1.84 112.428 155.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.55 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.64 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 2.25 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 0.74 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.89 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 1.16 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.58 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.29 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.64 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.81 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.34 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 1.74 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.55 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 0.7 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 0.55 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 0.49 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 2.12 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.35 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 2.24 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 4.39 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 2.71 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.96 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 1.57 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.94 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.01 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 2.68 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.16 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 1.98 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.36 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.66 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 1.77 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.22 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.59 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 2.44 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 4.83 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 0.59 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 2.9 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 2.95 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.64 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.49 -25.84 35.67 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 2.55 111.332 -176.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -62.84 -22.49 66.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.381 1.873 . . . . 2.07 112.523 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -66.23 -34.12 77.29 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.974 1.31 . . . . 5.28 112.843 170.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.4 ' CG ' HD12 ' A' ' 59' ' ' LEU . 20.3 m-30 -124.42 110.99 28.24 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.759 0.824 . . . . 2.34 113.079 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.54 -50.49 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.406 2.071 . . . . 2.41 113.448 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -163.8 52.55 0.15 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.233 1.968 . . . . 4.57 112.314 -171.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD12 ' CG ' ' A' ' 56' ' ' TYR 0.265 0.2 OUTLIER -91.19 -42.06 10.64 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 112.098 -2.319 . . . . 2.02 111.287 -163.764 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.328 1.451 . . . . 2.85 112.443 -151.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 119.326 -0.369 . . . . 15.64 110.067 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -94.72 72.03 3.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.878 1.271 . . . . 10.84 112.957 -171.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.6 136.34 40.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.823 -1.173 . . . . 4.74 111.679 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.39 11.56 68.19 Favored Glycine 0 CA--C 1.54 1.625 0 O-C-N 120.929 -1.107 . . . . 4.09 114.5 -178.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -94.29 -10.66 32.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.678 1.591 . . . . 4.69 114.058 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt -105.5 -23.97 12.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.814 1.246 . . . . 2.55 112.218 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 2.49 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.82 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 1.82 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' HIS . . . . . 0.441 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.24 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 4.84 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.11 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 1.85 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 6.55 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 5.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.75 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 -41.24 86.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 3.14 111.525 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.16 -39.1 96.82 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.689 1.138 . . . . 2.83 112.883 172.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -65.81 -38.36 88.74 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.369 1.068 . . . . 5.03 112.333 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -84.05 -39.18 19.91 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.453 1.279 . . . . 5.55 114.453 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.548 -1.691 . . . . 6.6 112.115 -173.279 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 118.767 -0.635 . . . . 4.48 111.425 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.55 10.56 40.78 Favored Glycine 0 CA--C 1.537 1.421 0 N-CA-C 116.278 1.271 . . . . 2.9 116.278 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.37 153.41 31.19 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.8 1.8 . . . . 2.88 112.995 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.454 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.44 110.374 165.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 2.45 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.514 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.43 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -86.82 -15.83 38.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.65 114.222 -171.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.8 t -77.84 126.0 84.74 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 119.401 1.0 . . . . 4.4 109.076 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.94 -29.18 34.83 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.781 1.654 . . . . 5.2 115.408 -155.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.52 -49.52 26.12 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.527 1.058 . . . . 4.8 112.689 -172.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt -67.73 -42.43 81.89 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.565 1.146 . . . . 2.42 110.232 165.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.56 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 2.54 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.582 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 0.75 113.709 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.36 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 0.83 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.05 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.57 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.89 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 0.95 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 2.02 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.582 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 0.74 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.55 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 0.29 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 1.97 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 1.77 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.47 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 2.09 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 3.54 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 2.9 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.97 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 1.45 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.49 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.36 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.05 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 2.22 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 0.87 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.28 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.45 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 1.91 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.92 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.55 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 1.73 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 3.67 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 0.48 113.604 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 2.3 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 3.76 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.69 115.592 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.69 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt -75.42 -23.89 57.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 2.29 111.014 -167.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -57.93 -19.2 28.25 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.314 1.845 . . . . 1.48 113.818 171.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -74.6 -20.04 60.08 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.279 1.955 . . . . 2.72 116.279 173.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -140.37 116.45 7.82 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 118.991 0.814 . . . . 2.12 111.758 -164.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.05 -53.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 121.504 1.469 . . . . 2.23 113.573 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -162.77 64.66 0.2 Allowed 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 124.598 2.142 . . . . 4.61 110.151 -173.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.272 1.1 tm? -116.02 -13.3 11.24 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 110.92 -2.854 . . . . 2.11 110.755 -156.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.193 2.597 . . . . 2.78 111.683 -167.405 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 111.07 0.026 . . . . 17.68 111.07 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 19.4 m80 55.43 53.99 9.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.617 1.967 . . . . 16.32 113.545 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 24.5 p -65.41 -7.94 16.35 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 116.553 2.057 . . . . 7.8 116.553 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.79 -170.75 42.16 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.062 1.791 . . . . 4.49 111.7 176.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -88.72 -37.58 15.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.136 1.161 . . . . 5.9 114.136 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' LEU . . . . . 0.508 ' H ' HD23 ' B' ' 66' ' ' LEU 0.311 2.5 pt? -77.57 -21.18 52.88 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 2.8 114.413 -177.105 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 2.36 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.61 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 1.73 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.37 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 3.47 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.95 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 2.77 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.06 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 6.76 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 1.58 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp -59.71 -55.87 28.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 3.8 110.145 168.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -55.9 -35.64 64.2 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.185 0.898 . . . . 2.29 113.345 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -65.63 -59.52 3.85 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.283 1.433 . . . . 5.56 112.001 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.52 -9.42 59.77 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.568 1.692 . . . . 5.82 115.568 -172.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.173 -1.394 . . . . 3.62 112.322 169.185 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.461 0.648 . . . . 5.69 112.724 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.69 -2.56 2.48 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.117 1.817 . . . . 2.99 116.454 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -102.43 171.63 7.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.073 1.436 . . . . 3.43 114.041 -163.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.442 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.12 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.561 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.65 151.95 19.58 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.87 113.588 -170.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.251 0.0 OUTLIER 62.73 156.17 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.59 1.956 . . . . 4.81 113.723 -164.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.03 25.11 0.57 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.925 2.417 . . . . 5.43 114.998 -164.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.64 -66.28 0.72 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.264 1.425 . . . . 3.36 110.45 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp -95.36 -23.09 17.33 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 1.5 112.365 160.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.04 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.34 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 2.18 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 0.65 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.19 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 0.88 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 1.54 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.76 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.71 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.11 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.81 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 1.68 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 0.55 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.44 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 0.38 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 2.01 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 1.73 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.4 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 2.31 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 2.87 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 2.85 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.73 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 1.36 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.01 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 1.81 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 1.86 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 1.79 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.53 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.42 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 1.7 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.47 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.97 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 1.74 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 5.31 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 0.62 113.626 171.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 2.05 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.18 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp -78.26 -22.29 48.58 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 3.53 110.722 -167.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -55.03 -23.8 21.53 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.038 1.735 . . . . 2.01 113.215 169.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -57.49 -39.83 77.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.076 0.951 . . . . 3.37 113.067 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -146.87 121.06 5.13 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.774 1.027 . . . . 2.81 113.774 -158.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -85.17 -35.1 0.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 121.947 1.765 . . . . 2.65 114.673 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -162.32 66.5 0.23 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 123.125 1.44 . . . . 4.01 111.488 -165.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.495 HD22 ' O ' ' A' ' 59' ' ' LEU 0.255 0.1 OUTLIER -128.4 -13.56 4.89 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 113.79 -1.55 . . . . 2.21 111.621 -161.648 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 127.079 2.152 . . . . 3.23 110.946 -163.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.448 0.642 . . . . 9.8 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -78.89 -29.89 44.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.877 -0.514 . . . . 12.17 111.187 167.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.47 36.83 6.46 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.133 1.373 . . . . 4.85 113.467 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.1 -14.04 30.28 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.412 1.958 . . . . 3.75 115.772 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -55.62 -27.59 50.41 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.57 1.148 . . . . 6.51 113.214 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER -138.11 -23.96 1.01 Allowed 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 2.85 114.943 165.257 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 1.92 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.44 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 1.32 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 1.43 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 4.95 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.73 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.05 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 3.69 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 7.98 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 1.43 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.87 -41.93 88.21 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 3.57 111.172 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.49 -36.86 59.12 Favored Glycine 0 CA--C 1.535 1.344 0 CA-C-N 118.954 0.797 . . . . 2.05 114.387 171.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -80.98 -19.01 44.97 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.037 1.418 . . . . 6.23 114.029 172.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.97 -24.12 38.28 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.476 1.658 . . . . 4.64 115.476 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 mm . . . . . 0 N--CA 1.492 1.659 0 CA-C-N 121.279 1.854 . . . . 4.12 111.773 177.868 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 31.7 t30 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 119.024 -0.512 . . . . 4.5 112.036 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.54 22.67 76.64 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.069 0.849 . . . . 2.96 114.074 177.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -93.19 161.75 14.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.935 1.694 . . . . 4.52 113.274 -165.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.53 111.937 172.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.01 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -146.81 159.83 43.02 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.2 p 58.76 -176.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 125.683 1.593 . . . . 4.74 114.662 -172.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.7 53.55 4.83 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 123.681 2.921 . . . . 5.97 112.611 -173.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.5 m -126.7 -98.49 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.958 2.103 . . . . 4.54 111.732 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp -91.22 -14.14 31.54 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.007 1.731 . . . . 1.79 113.406 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.33 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 4.09 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 1.07 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.86 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.11 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.31 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.09 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.29 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.12 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.06 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 1.93 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 0.97 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 0.79 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 0.31 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 2.07 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 1.41 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.58 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 2.24 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 2.76 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 3.02 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 1.79 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.78 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.61 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 1.71 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 1.66 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 42' ' ' CYS . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.03 115.808 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.37 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.37 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.403 ' HB2' ' HA2' ' A' ' 39' ' ' GLY . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.53 114.561 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 1.81 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.24 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.69 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 1.89 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 5.51 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 0.89 113.351 167.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 3.53 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 3.89 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.9 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp -74.33 -30.71 62.16 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 4.72 111.269 -170.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -71.81 -13.83 61.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.925 2.09 . . . . 3.12 114.019 178.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -80.89 -24.71 38.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.678 0.992 . . . . 4.19 113.678 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -120.31 118.28 31.3 Favored Pre-proline 0 C--O 1.237 0.446 0 N-CA-C 113.533 0.938 . . . . 3.46 113.533 -169.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -77.57 -26.76 6.81 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 122.704 2.269 . . . . 5.36 113.364 166.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -166.54 1.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 120.517 1.508 . . . . 8.79 115.017 -151.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -5.45 29.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.798 1.639 . . . . 4.96 113.604 -170.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 129.141 2.976 . . . . 5.32 113.562 -163.661 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 118.998 -0.525 . . . . 16.3 110.157 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -71.93 81.19 0.92 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.219 1.408 . . . . 16.66 113.006 -172.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 26.1 p -167.36 162.59 14.84 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.534 1.933 . . . . 9.8 110.998 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -173.6 -95.01 0.1 OUTLIER Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.279 -0.888 . . . . 6.4 113.527 172.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -53.32 -17.41 1.8 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 115.648 1.721 . . . . 6.91 115.648 -176.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.72 -23.43 63.16 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 3.62 114.281 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 3.8 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.36 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 2.35 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 2.98 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.0 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.72 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 1.68 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 3.8 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 7.08 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 1.75 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.19 -49.37 77.89 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 4.05 110.771 171.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.78 -28.53 63.22 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 119.349 -0.695 . . . . 3.32 114.5 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -79.13 -39.79 32.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.889 1.676 . . . . 3.96 113.311 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -81.96 -23.04 36.32 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.151 1.537 . . . . 4.74 115.151 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 tt . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.6 -1.191 . . . . 4.97 113.216 -175.345 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.391 -0.814 . . . . 4.59 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.28 27.84 67.26 Favored Glycine 0 CA--C 1.538 1.469 0 CA-C-N 120.631 1.56 . . . . 2.71 113.683 -170.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -136.06 166.73 22.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.26 114.46 -169.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.57 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.55 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 3.09 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CE3' HG21 ' A' ' 4' ' ' ILE . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.69 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -61.63 -18.58 60.06 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.68 113.567 174.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 67.0 m -75.24 127.25 86.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.377 1.071 . . . . 4.02 111.386 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -57.14 -19.02 31.7 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.114 3.209 . . . . 4.69 116.822 -171.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 p -53.23 -48.19 68.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.51 1.124 . . . . 4.04 112.865 168.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.45 HD22 ' CG2' ' A' ' 4' ' ' ILE . 8.0 mp -103.34 -18.11 14.99 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.263 1.025 . . . . 1.34 112.544 174.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 2.63 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 0.84 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.34 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 0.86 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.24 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.76 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.69 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.09 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.12 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 1.89 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 0.84 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 0.85 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 0.31 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 2.78 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 1.78 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.43 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 1.95 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 3.43 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 2.46 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.61 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 1.25 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.88 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 1.77 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 1.57 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.36 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.91 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.18 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.51 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 1.46 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.84 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.74 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 2.02 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 4.41 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 0.71 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 2.59 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 3.58 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.67 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.97 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt -75.97 -22.78 55.53 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.06 111.832 -168.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -58.74 -15.36 11.76 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.253 1.821 . . . . 1.6 113.369 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -70.25 -27.65 64.61 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.357 1.463 . . . . 4.02 114.877 172.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -142.33 121.68 7.85 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 124.251 1.021 . . . . 2.53 111.434 -170.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.78 -47.02 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.928 1.752 . . . . 2.38 113.312 -170.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -158.34 52.96 0.43 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 124.074 1.892 . . . . 3.79 113.542 -165.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.271 0.5 OUTLIER -116.71 -10.4 11.13 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.056 2.143 . . . . 1.88 111.463 -157.156 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 60' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.256 1.404 0 C-N-CA 125.941 1.696 . . . . 3.05 112.74 -165.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.483 1.222 0 N-CA-C 112.549 0.574 . . . . 14.14 112.549 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -139.87 -4.12 1.4 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.704 2.001 . . . . 9.13 114.72 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.1 t 63.69 -23.58 0.07 Allowed 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 117.574 2.435 . . . . 7.01 117.574 176.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.37 -170.51 31.39 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.534 1.54 . . . . 5.55 115.333 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -79.07 -2.33 39.96 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.016 1.858 . . . . 4.83 116.016 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -54.81 -27.61 43.1 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 2.42 115.009 -169.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 2.63 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.08 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 1.69 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.24 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 4.71 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.02 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 2.39 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 4.04 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 6.46 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.29 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.05 -47.69 83.6 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 4.35 111.756 170.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.94 -32.14 62.07 Favored Glycine 0 CA--C 1.538 1.483 0 O-C-N 121.493 -0.754 . . . . 2.55 114.037 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -81.58 -28.53 33.76 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.639 1.576 . . . . 3.92 113.403 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -87.23 -19.13 28.78 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 127.576 2.351 . . . . 4.06 115.327 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 124.51 1.124 . . . . 5.26 110.18 165.306 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 118.46 -0.781 . . . . 6.15 111.411 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.413 ' HA3' ' CD1' ' A' ' 32' ' ' TYR . . . 57.61 21.09 41.38 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.017 1.77 . . . . 3.35 116.775 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -90.98 -19.37 23.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.46 116.694 -161.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.32 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.14 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.24 4.78 37.29 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.31 113.426 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.9 m -86.93 -71.43 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 CA-C-O 117.197 -1.382 . . . . 6.46 112.319 173.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.38 177.15 8.28 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.639 2.226 . . . . 7.4 110.942 169.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.7 p -74.61 31.19 0.09 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.533 1.679 . . . . 3.1 115.533 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp -70.98 -16.97 62.67 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.479 -1.388 . . . . 1.73 114.301 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.41 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.64 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 2.02 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 0.79 115.095 -167.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.24 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.72 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 0.96 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.51 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.82 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.68 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.414 ' HD2' ' HB2' ' A' ' 15' ' ' ALA . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 1.79 112.854 169.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 0.85 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.56 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 0.33 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 2.02 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 1.87 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.42 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.436 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 2.7 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.06 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.413 ' CD1' ' HA3' ' A' ' 2' ' ' GLY . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 2.44 113.339 162.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.61 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 1.09 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.26 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.67 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 3.63 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 2.82 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.39 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.45 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.47 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.54 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 1.5 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.9 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 2.02 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 3.73 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 0.55 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 2.44 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.16 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.55 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt -79.58 -17.82 53.06 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 2.3 111.933 -168.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -61.51 -21.75 64.51 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.889 1.676 . . . . 1.55 113.352 167.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -62.33 -38.24 88.7 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.168 1.387 . . . . 2.41 112.852 174.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.605 ' HB3' HD12 ' A' ' 59' ' ' LEU . 11.2 m-85 -133.01 131.62 21.99 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.111 0.782 . . . . 2.18 113.111 -165.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.89 -48.47 0.15 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.778 2.319 . . . . 2.35 113.292 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -156.02 9.08 0.25 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.323 1.849 . . . . 4.03 111.787 -165.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -79.89 -14.04 58.94 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 119.466 -2.021 . . . . 1.83 115.435 -141.558 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.412 ' CD2' ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 C-N-CA 126.175 1.79 . . . . 3.17 113.416 -160.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.195 -0.298 . . . . 10.77 110.195 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -81.55 -21.5 38.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.753 1.76 . . . . 10.16 115.753 -172.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 43.5 t -73.46 135.1 44.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.897 0.771 . . . . 4.41 112.273 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.9 -2.27 0.03 OUTLIER Glycine 0 CA--C 1.54 1.599 0 N-CA-C 116.178 1.231 . . . . 3.47 116.178 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -66.44 -32.37 73.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.722 1.761 . . . . 5.3 114.201 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt -76.83 -34.16 57.91 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.34 0.973 . . . . 2.84 110.872 173.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 2.94 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.14 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 1.35 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.19 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 4.54 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.94 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.0 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 3.31 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 7.77 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 1.06 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.55 -46.09 89.91 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 3.33 110.621 174.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.78 -35.74 87.46 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.887 1.232 . . . . 1.87 114.576 178.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -76.49 -34.88 58.63 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.596 1.198 . . . . 3.7 112.394 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -69.65 -29.55 67.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.491 0.922 . . . . 4.65 113.491 173.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 C--O 1.254 1.297 0 CA-C-O 116.699 -1.619 . . . . 3.62 112.757 177.979 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 112.779 0.659 . . . . 4.49 112.779 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.56 -42.22 0.42 Allowed Glycine 0 CA--C 1.541 1.694 0 C-N-CA 126.473 1.987 . . . . 2.44 113.857 -169.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -25.88 147.27 0.0 OUTLIER 'General case' 0 C--O 1.236 0.361 1 C-N-CA 131.94 4.096 . . . . 4.88 116.396 168.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.56 111.815 170.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.09 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.35 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.89 -23.87 62.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.17 113.301 175.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.7 m -67.84 123.52 87.24 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 118.312 -0.851 . . . . 5.03 109.947 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 85.6 Cg_exo -62.32 -34.91 76.16 Favored 'Trans proline' 0 C--N 1.355 0.917 0 N-CA-C 117.76 2.177 . . . . 4.39 117.76 -156.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.28 -55.69 5.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.544 0.737 . . . . 4.24 112.095 -173.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.62 -41.63 99.12 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.839 1.655 . . . . 1.95 109.905 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.53 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.28 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 2.26 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.36 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.36 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.15 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HG2' HD11 ' A' ' 59' ' ' LEU . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 1.49 115.635 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.16 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 0.96 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.39 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.15 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 1.57 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 0.6 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.47 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 0.35 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 2.18 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.38 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.48 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 3.56 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 3.63 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 2.78 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.77 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 1.25 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.83 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 2.67 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 2.47 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.25 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.51 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.41 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 1.47 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.08 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 1.77 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 3.52 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 0.53 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 2.38 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 3.22 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.91 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm -74.8 -18.84 60.4 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 4.5 111.839 -169.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -73.42 -27.25 61.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.469 1.908 . . . . 1.37 113.289 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' CZ ' ' A' ' 56' ' ' TYR . 26.6 mtmt -67.48 -31.94 72.42 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.479 1.659 . . . . 2.8 115.479 -171.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' ' HE3' ' A' ' 55' ' ' LYS . 8.0 m-85 -118.71 126.56 27.07 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 123.025 0.53 . . . . 2.92 112.013 -161.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -86.38 -21.82 2.28 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.082 2.521 . . . . 5.01 113.815 175.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.08 -2.22 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.046 1.498 . . . . 8.36 115.046 -150.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD11 ' HG2' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -82.76 -8.71 59.57 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.737 1.215 . . . . 3.86 113.22 -161.098 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 C--O 1.251 1.175 0 C-N-CA 127.553 2.341 . . . . 4.52 113.817 -163.84 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.539 -0.171 . . . . 13.18 110.539 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -62.68 144.15 56.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.922 0.889 . . . . 10.04 112.503 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 48.5 t -83.18 -51.83 7.14 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.926 0.891 . . . . 4.72 110.544 167.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.01 143.78 3.77 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.469 1.033 . . . . 4.04 114.516 171.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 53.3 t60 -67.14 -35.38 79.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.728 1.211 . . . . 5.89 113.111 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -88.42 -10.31 49.63 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 4.66 115.285 -163.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 2.55 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.26 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 1.36 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 1.69 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 4.53 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.37 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 1.92 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 3.4 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 5.41 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 0.97 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -65.55 -48.74 71.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 3.86 110.85 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.16 91.52 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 123.496 0.569 . . . . 1.93 113.006 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -66.14 -40.32 90.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.258 1.423 . . . . 3.43 112.844 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -73.15 -40.97 64.44 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.438 1.644 . . . . 3.15 115.438 -177.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 pt . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 115.869 1.803 . . . . 4.06 115.869 -170.518 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 117.601 -1.19 . . . . 4.75 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.69 19.64 55.23 Favored Glycine 0 CA--C 1.537 1.409 0 CA-C-N 120.13 1.332 . . . . 2.69 113.832 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -118.33 159.18 23.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.302 1.841 . . . . 3.23 112.284 -157.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.55 111.105 177.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 3.46 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.607 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.59 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -95.19 -47.91 6.15 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.51 115.389 -151.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.3 t -153.34 -56.86 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 125.357 1.463 . . . . 6.56 109.774 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -63.33 169.44 9.5 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.046 1.83 . . . . 5.51 111.714 159.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.6 m 48.55 -101.58 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.646 1.578 . . . . 6.66 113.616 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.539 HD23 ' CE2' ' A' ' 23' ' ' PHE . 8.7 mp -93.43 8.42 40.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.378 1.471 . . . . 1.88 114.06 -171.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.32 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.9 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.408 ' HG2' ' CZ ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 2.48 114.782 -175.351 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.17 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.82 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.35 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 1.6 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 0.97 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.63 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.539 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 2.14 112.357 168.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 0.89 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.61 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 0.39 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.407 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 2.11 113.151 -178.358 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 1.74 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 2.41 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 2.79 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 2.55 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.93 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 1.45 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.95 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.08 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 1.62 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 1.68 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 1.44 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.68 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.11 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.53 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 1.48 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.33 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.64 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 1.84 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 4.15 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 0.96 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 3.52 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 3.69 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.51 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt -74.91 -21.73 59.04 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 1.99 111.923 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -56.74 -17.73 10.06 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.503 1.921 . . . . 2.31 113.519 167.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -68.92 -29.82 68.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.763 1.625 . . . . 3.35 114.48 172.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -145.41 125.36 7.07 Favored Pre-proline 0 N--CA 1.471 0.603 0 CA-C-N 118.889 0.768 . . . . 2.83 112.874 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -88.73 -30.91 0.19 Allowed 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.288 1.992 . . . . 2.72 115.95 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -161.5 59.96 0.27 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.527 1.156 . . . . 4.52 113.369 -163.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.281 0.7 OUTLIER -137.51 -10.44 1.64 Allowed 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 114.353 -1.294 . . . . 2.01 111.922 -156.732 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.3 p90 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 126.709 2.004 . . . . 2.97 112.704 -166.631 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 111.261 0.097 . . . . 19.09 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -129.16 145.65 51.27 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.341 1.457 . . . . 14.33 113.657 -173.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.9 t -57.09 -34.94 68.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.591 1.556 . . . . 8.78 113.996 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.53 -20.29 78.32 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 115.681 1.032 . . . . 4.89 115.681 176.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -121.8 -25.11 5.1 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.956 1.465 . . . . 5.71 114.956 -170.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp -55.86 -22.01 22.95 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.751 1.16 . . . . 3.59 113.968 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 3.11 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.32 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 1.68 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 2.77 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.22 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.03 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.25 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 3.37 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 9.26 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 1.93 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.64 -44.26 94.37 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 3.8 111.563 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.3 -32.0 71.92 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.306 0.955 . . . . 2.77 113.778 174.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -70.13 -37.59 75.34 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.384 1.473 . . . . 4.79 112.993 173.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -72.03 -43.92 64.22 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.344 1.058 . . . . 5.01 112.974 173.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.381 11.1 tp . . . . . 0 N--CA 1.481 1.116 0 C-N-CA 129.25 3.02 . . . . 5.83 114.903 -170.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 118.661 -0.685 . . . . 3.84 110.535 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 24.43 46.84 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.31 0.959 . . . . 2.1 115.056 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -69.69 156.64 38.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.839 1.319 . . . . 3.1 113.502 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.531 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.11 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.554 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.34 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.59 -22.22 66.91 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.31 112.442 168.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.8 p -70.44 120.03 76.03 Favored Pre-proline 0 CA--C 1.546 0.791 0 O-C-N 121.353 -0.842 . . . . 5.03 110.767 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.42 -17.2 44.05 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 4.19 114.675 -160.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.69 -27.5 64.05 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.266 -0.896 . . . . 3.11 112.603 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -98.15 -24.25 15.37 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.604 1.093 . . . . 1.26 112.341 159.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.14 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.41 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.466 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.39 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 0.93 113.445 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.08 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.7 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.03 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.69 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.83 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 0.7 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.466 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 1.61 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 0.67 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 0.71 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 0.32 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 2.1 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.32 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.41 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 2.7 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 2.72 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 2.25 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.66 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 1.13 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.53 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.94 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 2.15 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 1.76 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.29 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 1.51 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.76 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.64 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 1.35 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.82 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.58 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 1.69 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 3.91 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 0.56 112.231 172.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 2.59 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.25 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.71 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt -78.32 -15.71 58.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.05 112.229 -168.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -52.8 -23.47 6.97 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.445 1.898 . . . . 1.79 113.377 164.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -68.78 -42.15 77.78 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.787 1.235 . . . . 3.19 113.063 175.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.583 ' HB3' HD12 ' A' ' 59' ' ' LEU . 16.9 m-85 -139.22 117.35 8.88 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.969 1.1 . . . . 2.17 113.969 -163.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -81.67 -26.99 2.84 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.55 2.833 . . . . 2.35 114.726 -168.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -157.34 1.79 0.12 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.47 1.508 . . . . 4.26 113.927 -171.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.583 HD12 ' HB3' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -81.34 -8.78 59.8 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 119.791 -1.818 . . . . 1.88 114.456 -140.945 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.388 2.275 . . . . 2.75 113.847 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.529 -0.545 . . . . 11.08 109.529 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -121.91 -22.29 5.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.353 1.461 . . . . 8.87 113.476 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.4 m -55.08 138.35 44.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.359 0.981 . . . . 4.39 111.161 175.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.89 -152.98 11.77 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.909 1.243 . . . . 3.39 110.495 -170.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 49.4 t60 37.88 -85.98 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.097 2.559 . . . . 5.98 115.109 174.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -53.08 -33.59 52.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.38 1.446 . . . . 2.51 113.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 2.36 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.5 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 1.48 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 1.37 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 4.5 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.56 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 1.66 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 2.61 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 5.27 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 0.89 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt -72.42 -43.74 63.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 3.29 111.892 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.09 -39.12 91.66 Favored Glycine 0 CA--C 1.535 1.309 0 CA-C-N 118.826 0.739 . . . . 1.7 113.152 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -67.11 -38.35 85.48 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.369 1.068 . . . . 3.56 112.759 171.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -70.25 -31.16 68.42 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 117.336 -1.316 . . . . 3.57 114.081 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 70.7 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.468 -1.253 . . . . 4.39 112.374 176.446 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 118.979 -0.534 . . . . 4.18 110.671 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.21 23.24 57.29 Favored Glycine 0 CA--C 1.536 1.397 0 CA-C-N 119.355 0.98 . . . . 2.22 114.929 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.2 150.07 44.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.161 1.481 . . . . 2.97 114.007 -173.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.469 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.95 112.803 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.46 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.485 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -115.64 -12.33 11.59 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.29 113.008 167.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 86.8 p -60.46 156.88 39.35 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.621 1.168 . . . . 5.35 113.658 -176.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.84 131.3 41.44 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 5.52 115.066 -165.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 56.4 m 60.45 -38.24 0.09 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.861 3.264 . . . . 5.16 116.056 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.85 -35.19 72.53 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.041 1.337 . . . . 2.34 110.553 168.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.63 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 1.76 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.501 ' HB1' ' CE ' ' A' ' 24' ' ' LYS 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 0.9 114.814 -172.615 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.29 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 0.8 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.38 114.525 166.449 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.61 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.81 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 0.82 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 1.95 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.501 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 0.58 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.49 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 0.31 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 1.97 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.35 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.41 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 2.69 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 2.71 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 2.4 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.67 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 1.09 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.62 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.85 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 1.9 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 1.81 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.37 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.44 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.97 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.7 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 2.11 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.12 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 1.72 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 5.64 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 0.63 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 2.33 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.05 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.06 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.69 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt -79.74 -21.0 45.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.0 112.078 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.56 -11.81 12.77 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.584 1.954 . . . . 1.6 113.368 168.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.57 -40.31 50.03 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.17 1.788 . . . . 3.72 114.582 173.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -136.39 119.22 12.02 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 118.884 0.765 . . . . 2.19 111.904 -164.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -88.7 -31.84 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.235 1.957 . . . . 2.22 116.313 -171.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -161.93 75.85 0.48 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 123.049 1.404 . . . . 4.03 112.012 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.299 1.2 tm? -138.03 -8.41 1.58 Allowed 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.246 -1.343 . . . . 1.99 111.61 -161.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 6.6 p90 . . . . . 0 C--O 1.257 1.457 0 C-N-CA 127.466 2.307 . . . . 3.17 114.478 -166.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 119.782 -0.152 . . . . 13.13 111.344 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -82.22 55.62 2.92 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.0 1.32 . . . . 10.37 111.837 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -70.92 -40.87 71.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.135 0.974 . . . . 4.57 112.092 -176.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' GLY . . . . . 0.426 ' HA2' HG22 ' B' ' 67' ' ' ILE . . . -80.16 18.41 8.11 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 116.222 1.249 . . . . 3.5 116.222 -171.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -63.37 -33.38 75.4 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.039 1.496 . . . . 5.44 115.039 -168.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt -111.69 -23.47 10.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.775 1.23 . . . . 3.06 113.272 175.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.426 HG22 ' HA2' ' B' ' 64' ' ' GLY . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 1.8 114.833 -172.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 1.25 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.24 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 5.22 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.47 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 1.53 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 3.39 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 5.48 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.09 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.66 -46.38 85.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 4.13 112.13 174.072 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.9 -27.93 67.68 Favored Glycine 0 CA--C 1.539 1.542 0 CA-C-N 118.984 0.811 . . . . 2.23 114.39 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -82.12 -32.5 30.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.255 1.022 . . . . 3.48 112.63 172.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -72.84 -44.34 61.54 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.513 1.301 . . . . 3.88 114.513 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 117.898 -1.048 . . . . 4.87 113.715 -173.913 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 118.212 -0.899 . . . . 4.46 111.067 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.13 14.68 59.59 Favored Glycine 0 CA--C 1.54 1.655 0 CA-C-N 120.141 1.337 . . . . 2.72 115.906 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -74.23 167.95 20.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.116 1.766 . . . . 3.75 113.447 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 4' ' ' ILE . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.01 110.334 162.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.09 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.533 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.31 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -146.61 157.35 43.7 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.05 110.183 -174.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.9 t 64.36 130.64 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 127.535 2.334 . . . . 4.9 112.734 -154.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.43 -14.46 37.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.165 2.577 . . . . 5.58 115.942 -159.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.4 p -57.11 -51.21 70.21 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.789 1.177 . . . . 3.15 112.812 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt -95.57 -31.42 13.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.839 1.656 . . . . 1.83 110.666 166.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.32 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.36 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 1.75 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 0.73 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 0.74 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 1.47 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.64 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.48 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.03 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.79 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 2.3 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 1.09 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.5 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 0.33 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 2.14 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.24 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 2.35 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 2.62 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 2.16 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.16 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 1.36 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.14 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.32 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 1.84 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 1.95 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.28 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.53 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.6 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 1.93 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.57 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.59 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 2.1 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 3.56 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 0.51 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 2.6 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 3.17 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.43 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp -78.9 -19.61 51.44 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 3.23 111.655 -170.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -62.42 -14.38 40.04 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.727 1.611 . . . . 1.43 113.866 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -65.45 -37.68 87.6 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.355 0.98 . . . . 2.82 113.327 172.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -142.75 132.24 11.97 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.729 1.011 . . . . 2.7 113.729 -159.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -93.06 -36.11 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.931 2.421 . . . . 2.31 115.484 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -154.59 65.95 0.68 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.298 1.523 . . . . 5.11 111.687 -157.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.27 0.3 OUTLIER -145.45 -8.54 0.58 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 112.842 -1.981 . . . . 1.91 110.587 -156.155 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.25 1.1 0 C-N-CA 127.487 2.315 . . . . 2.74 112.983 -165.859 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.271 0.081 . . . . 11.57 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -59.28 -31.8 69.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.58 1.552 . . . . 10.97 113.891 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.4 t -157.66 148.63 21.29 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.488 1.515 . . . . 4.99 110.611 -176.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 171.93 -7.39 0.04 OUTLIER Glycine 0 CA--C 1.537 1.451 0 N-CA-C 118.435 2.134 . . . . 3.19 118.435 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -88.14 -43.09 11.91 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.265 2.033 . . . . 5.91 113.928 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -59.07 -35.78 73.95 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 3.42 114.209 -173.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 2.53 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.92 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 1.26 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.31 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 3.48 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.76 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 1.91 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 2.61 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 4.73 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 0.94 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.37 -51.65 57.77 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.01 110.439 167.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.97 -36.0 54.99 Favored Glycine 0 CA--C 1.54 1.613 0 CA-C-O 119.461 -0.633 . . . . 2.05 114.635 174.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -80.56 -21.99 41.2 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.317 1.559 . . . . 5.39 114.833 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -102.03 -27.29 13.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.601 1.704 . . . . 4.42 115.601 -178.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 10.9 tp . . . . . 0 C--O 1.256 1.403 0 C-N-CA 125.205 1.402 . . . . 3.54 114.265 -171.766 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 119.863 -0.113 . . . . 5.41 110.737 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.06 26.1 53.8 Favored Glycine 0 CA--C 1.534 1.253 0 O-C-N 121.376 -0.827 . . . . 3.83 114.931 -175.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -57.22 170.24 0.5 Allowed 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.039 0.919 . . . . 3.55 113.395 176.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 11' ' ' LEU . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.91 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -137.09 -49.85 0.63 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.47 115.113 -169.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.3 m -79.43 -34.74 0.93 Allowed Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 116.047 1.869 . . . . 4.79 116.047 -173.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -79.4 178.23 7.64 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.736 2.291 . . . . 7.24 110.99 160.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 m -67.4 -0.57 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.036 -1.665 . . . . 3.75 114.746 -176.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 4' ' ' ILE . 4.5 mp -63.3 -16.82 61.51 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 120.891 -1.13 . . . . 1.23 111.782 165.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.49 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 2.26 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 0.69 113.884 -166.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.38 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.73 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 0.95 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.44 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.28 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.06 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.617 ' CE2' HD23 ' A' ' 11' ' ' LEU . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 2.27 112.662 172.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 0.65 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 0.88 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 0.33 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.419 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 2.06 112.632 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 1.53 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.6 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 2.39 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 2.56 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 2.81 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 0.89 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 1.33 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.95 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 1.63 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 1.81 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.5 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 1.71 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.92 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.7 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 2.56 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.78 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.07 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 2.36 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 4.32 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 0.9 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 2.78 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 3.29 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.35 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.97 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt -78.56 -17.13 56.59 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.04 112.224 -171.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.2 pp0? -66.94 -16.76 64.55 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.998 2.119 . . . . 1.66 113.477 167.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -77.65 -55.1 5.63 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.071 0.949 . . . . 2.41 111.062 166.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.45 ' HB3' ' CG ' ' A' ' 59' ' ' LEU . 9.5 m-85 -115.97 103.24 53.62 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.655 0.782 . . . . 2.42 111.563 -166.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.61 -40.82 9.49 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.521 2.814 . . . . 2.63 114.227 -164.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -158.61 4.96 0.11 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 122.062 0.934 . . . . 4.82 112.986 -167.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CG ' ' HB3' ' A' ' 56' ' ' TYR . 0.4 OUTLIER -83.54 5.32 24.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.512 1.301 . . . . 2.47 114.512 -139.681 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.426 1.89 . . . . 3.53 113.327 -158.496 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.255 0.55 . . . . 12.12 111.243 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -70.77 -22.46 62.39 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.964 1.306 . . . . 13.23 113.798 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.8 t -76.01 126.35 30.84 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.669 1.587 . . . . 5.8 110.743 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.24 -37.35 3.12 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.036 0.827 . . . . 4.33 114.335 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -46.17 -21.25 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 118.919 2.933 . . . . 5.11 118.919 -163.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER -135.09 -19.26 1.75 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 120.5 1.5 . . . . 2.73 114.853 170.151 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 2.5 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.01 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 1.56 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 44.1 m170 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.32 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 4.94 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 1.63 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 2.86 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 5.25 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 1.28 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.6 -37.95 73.92 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 4.76 111.729 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.96 -27.11 73.5 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.673 1.124 . . . . 3.25 113.932 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -68.8 -43.39 75.74 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.003 1.401 . . . . 4.49 112.383 164.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -75.58 -53.84 7.97 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.368 1.467 . . . . 3.3 114.698 -171.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.285 23.3 pt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 128.819 2.848 . . . . 6.85 115.668 -176.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 112.823 0.675 . . . . 4.3 112.823 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.93 -13.64 0.2 Allowed Glycine 0 CA--C 1.546 2.005 0 C-N-CA 125.99 1.757 . . . . 2.12 116.816 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -69.98 165.81 20.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 129.911 3.284 . . . . 2.84 115.743 -165.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.85 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.36 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.04 133.35 34.88 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 2.88 113.128 -163.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 p 60.51 173.58 0.05 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 127.926 2.49 . . . . 5.38 116.693 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -65.51 21.94 0.08 OUTLIER 'Trans proline' 0 CA--C 1.547 1.159 1 C-N-CA 125.375 4.05 . . . . 7.45 117.051 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.5 m -82.91 -127.41 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.974 2.11 . . . . 4.2 110.155 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -55.53 -34.41 64.65 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 120.801 -1.187 . . . . 1.69 110.835 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.38 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.24 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 2.07 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 0.9 113.369 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.11 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.7 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.03 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.74 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.47 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.08 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.68 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 2.2 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 0.72 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 0.72 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 0.31 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 1.98 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 1.57 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 2.45 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 2.76 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 2.59 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 0.81 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 1.25 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.41 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.33 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 1.86 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 2.06 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.14 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.33 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.17 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.43 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 2.16 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.9 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 1.78 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.03 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 0.69 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 2.66 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 4.67 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.74 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.74 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt -73.26 -18.64 61.2 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 2.48 111.414 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -53.28 -30.18 37.28 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.566 1.547 . . . . 2.03 113.123 165.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -59.83 -27.71 66.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.157 1.783 . . . . 3.34 114.649 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -144.25 123.75 7.27 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 124.234 1.013 . . . . 3.14 111.002 -172.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.94 -38.55 0.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 121.947 1.765 . . . . 2.36 114.759 -175.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -158.07 60.14 0.46 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 123.12 1.438 . . . . 4.13 114.226 -165.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.252 1.0 OUTLIER -134.38 -7.52 2.57 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.273 -1.785 . . . . 2.3 112.024 -156.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.924 2.09 . . . . 2.95 110.338 -170.207 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 119.345 -0.36 . . . . 17.28 111.431 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t60 68.83 142.83 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.914 2.486 . . . . 9.51 115.228 -175.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.41 125.22 23.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.33 1.452 . . . . 5.38 112.282 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 8.94 87.09 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 115.442 0.937 . . . . 4.24 115.442 175.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -55.22 -48.02 74.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.034 1.333 . . . . 4.91 112.9 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt -75.21 -5.34 43.94 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 3.86 115.496 -167.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 3.13 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.84 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 1.3 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.27 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 4.9 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.48 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 1.69 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 3.76 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 5.94 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 1.33 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.1 -41.54 92.75 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 3.69 111.282 171.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.31 -33.74 81.88 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.443 1.021 . . . . 2.18 114.142 175.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -75.61 -35.99 60.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.454 1.127 . . . . 4.1 112.712 172.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -86.0 -19.33 30.53 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.733 1.753 . . . . 4.53 115.733 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 8.8 tp . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 114.548 1.314 . . . . 4.56 114.548 177.08 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 . . . . . 0 CA--C 1.543 0.693 0 N-CA-C 114.754 1.39 . . . . 3.3199999999999998 114.754 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.1299999999999999 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 2.6600000000000001 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.3100000000000001 113.382 172.87 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt . . . . . 0 N--CA 1.47 0.573 0 N-CA-C 109.366 -0.605 . . . . 2.0 109.366 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.24 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.1899999999999999 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 1.73 112.763 166.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 0.92000000000000004 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.25 110.799 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.80000000000000004 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.03 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.97999999999999998 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.51000000000000001 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.2200000000000002 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.70999999999999996 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 2.6400000000000001 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 0.92000000000000004 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.5 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 0.28000000000000003 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 2.0899999999999999 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.3100000000000001 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.46999999999999997 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.426 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 2.27 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.02 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 2.79 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.0600000000000001 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 1.3999999999999999 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.8999999999999999 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 1.52 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 1.5600000000000001 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 0.87 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 1.72 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.60999999999999999 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 1.8 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.1499999999999999 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.68999999999999995 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 1.6599999999999999 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.1299999999999999 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 0.71999999999999997 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 2.3700000000000001 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.0300000000000002 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.0700000000000001 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt . . . . . 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.1800000000000002 111.262 -170.753 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt . . . . . 0 CA--C 1.55 0.966 0 N-CA-C 113.127 0.788 . . . . 3.8300000000000001 113.127 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 2.2999999999999998 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.8199999999999998 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 1.3100000000000001 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.22 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 4.1900000000000004 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9000000000000004 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 1.51 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 2.9199999999999999 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 5.9500000000000002 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 0.96999999999999997 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt . . . . . 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 3.2599999999999998 111.485 171.236 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 N--CA 1.45 -0.441 0 CA-C-O 121.669 0.747 . . . . 3.6499999999999999 112.615 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.4399999999999999 112.491 177.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 1.96 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.7200000000000002 111.269 168.522 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.403 HD23 ' CE2' ' A' ' 23' ' ' PHE . 6.3 mp . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 118.787 -0.625 . . . . 1.4099999999999999 111.76 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.24 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 2.27 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 0.67000000000000004 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.67000000000000004 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 0.88 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.60999999999999999 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.46000000000000002 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.9399999999999999 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.80000000000000004 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.403 ' CE2' HD23 ' A' ' 11' ' ' LEU . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 2.3199999999999998 113.209 171.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 0.62 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 0.42999999999999999 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 0.33000000000000002 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 2.7200000000000002 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.0600000000000001 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.47999999999999998 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 2.0699999999999998 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 2.8100000000000001 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 2.3199999999999998 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.83999999999999997 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 1.25 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.0600000000000001 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.6800000000000002 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 1.6100000000000001 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.0299999999999998 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.0 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.5900000000000001 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.1800000000000002 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.60999999999999999 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 1.72 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78000000000000003 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 2.0299999999999998 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 4.3099999999999996 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 0.71999999999999997 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 2.98 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 2.98 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.1200000000000001 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt . . . . . 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 2.3100000000000001 112.438 -172.071 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.252 0.6 OUTLIER . . . . . 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 3.0800000000000001 115.315 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 3.6899999999999999 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.5199999999999996 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.1099999999999999 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.48 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 5.6799999999999997 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.3600000000000003 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 1.98 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.0800000000000001 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 7.9500000000000002 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 1.4299999999999999 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 3.3999999999999999 112.441 173.701 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 CA--C 1.539 0.548 0 CA-C-O 122.195 0.998 . . . . 3.8700000000000001 112.862 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.4900000000000002 114.481 171.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.3999999999999999 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.632 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.5600000000000001 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 . . . . . 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.3799999999999999 114.212 174.384 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 113.934 1.087 . . . . 1.49 113.934 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.5600000000000001 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 2.6200000000000001 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 0.71999999999999997 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.6899999999999999 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 0.90000000000000002 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.25 116.811 175.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.60999999999999999 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.45000000000000001 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.1100000000000003 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.72999999999999998 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 1.6599999999999999 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.632 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 0.80000000000000004 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 0.67000000000000004 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 0.37 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 2.2999999999999998 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.3799999999999999 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51000000000000001 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 2.3999999999999999 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 4.8799999999999999 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 2.6099999999999999 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.95999999999999996 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 1.5700000000000001 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.4400000000000004 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 1.5700000000000001 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 2.29 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 0.91000000000000003 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 1.95 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.6299999999999999 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.57999999999999996 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 1.8600000000000001 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.73999999999999999 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 1.6799999999999999 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 4.4900000000000002 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 0.66000000000000003 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 4.2300000000000004 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.4700000000000002 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.90000000000000002 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm . . . . . 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 4.0499999999999998 111.304 -169.775 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 2.75 113.856 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.0499999999999998 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.0800000000000001 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 1.25 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 1.5700000000000001 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 5.1900000000000004 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.6600000000000001 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.46 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 3.8799999999999999 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 5.4900000000000002 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.04 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.0700000000000003 111.537 171.174 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.6699999999999999 120.387 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.44 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 2.21 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 t30 . . . . . 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 3.5 110.817 -176.001 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 CA--C 1.542 0.661 0 N-CA-C 109.552 -0.536 . . . . 2.1099999999999999 109.552 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 1.9099999999999999 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.78 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 2.3199999999999998 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 0.96999999999999997 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.3899999999999999 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 1.6100000000000001 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.76000000000000001 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 0.91000000000000003 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.1400000000000001 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.90000000000000002 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 2.3399999999999999 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 0.92000000000000004 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.52000000000000002 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 0.38 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 2.0699999999999998 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.3899999999999999 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56000000000000005 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 2.0600000000000001 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 4.9299999999999997 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 3.3700000000000001 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.97999999999999998 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 1.55 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.2400000000000002 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 2.0899999999999999 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 1.8700000000000001 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.3500000000000001 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 1.55 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.0699999999999998 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52000000000000002 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 1.71 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.0699999999999998 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.56999999999999995 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 1.76 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 7.4400000000000004 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 0.64000000000000001 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 4.0800000000000001 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.0700000000000003 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.3300000000000001 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp . . . . . 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 3.9199999999999999 111.403 -170.872 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? . . . . . 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 2.54 114.001 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 2.6499999999999999 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2000000000000002 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 1.3899999999999999 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 1.8899999999999999 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 3.9900000000000002 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 1.75 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 2.5800000000000001 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 7.7199999999999998 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.2 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp . . . . . 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 2.8700000000000001 112.756 169.465 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 . . . . . 0 CA--C 1.536 0.418 0 N-CA-C 112.726 0.639 . . . . 4.9000000000000004 112.726 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 2.4300000000000002 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.499 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.7200000000000002 113.549 176.266 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt . . . . . 0 N--CA 1.473 0.683 0 CA-C-O 120.607 0.241 . . . . 1.75 110.397 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.26 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 2.0099999999999998 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 0.68999999999999995 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.1499999999999999 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.68000000000000005 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.03 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.59999999999999998 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.48999999999999999 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.6600000000000001 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.77000000000000002 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 1.6100000000000001 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 0.62 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.48999999999999999 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 0.31 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 2.0499999999999998 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 1.75 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51000000000000001 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 2.3300000000000001 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 2.8799999999999999 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 2.6800000000000002 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 0.81999999999999995 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 1.1699999999999999 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.9300000000000002 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.8500000000000001 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 1.5700000000000001 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 1.6399999999999999 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 0.89000000000000001 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.29 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7000000000000002 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.53000000000000003 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 1.8400000000000001 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.1400000000000001 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 0.75 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 2.0899999999999999 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 4.9299999999999997 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 0.62 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 3.3300000000000001 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 4.0700000000000003 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.4100000000000001 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.71999999999999997 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt . . . . . 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 2.3300000000000001 111.781 -170.396 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 3.1699999999999999 113.685 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 2.2599999999999998 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.9900000000000002 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 1.27 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.26 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 3.9100000000000001 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.6800000000000002 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.1499999999999999 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 2.8700000000000001 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 5.6799999999999997 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.22 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt . . . . . 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 3.48 111.161 173.627 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.576 0.954 . . . . 3.7200000000000002 113.576 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.418 HG21 HD22 ' A' ' 11' ' ' LEU . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.9900000000000002 110.213 156.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.3599999999999999 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.3100000000000001 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.2400000000000002 115.571 -168.706 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.418 HD22 HG21 ' A' ' 4' ' ' ILE . 2.8 mp . . . . . 0 CA--C 1.548 0.879 0 CA-C-O 118.985 -0.531 . . . . 1.4299999999999999 111.286 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.23 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 1.9099999999999999 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 0.72999999999999998 114.073 -175.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.1499999999999999 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 0.69999999999999996 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.0900000000000001 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.56999999999999995 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.47999999999999998 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 0.73999999999999999 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 1.6499999999999999 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.598 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 0.62 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.52000000000000002 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 0.37 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 2.8700000000000001 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 1.9399999999999999 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.41999999999999998 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 2.3799999999999999 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 4.0099999999999998 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 2.4500000000000002 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 0.81999999999999995 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.1699999999999999 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 1.71 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 1.6799999999999999 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 0.90000000000000002 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 1.8100000000000001 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.1499999999999999 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.44 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 1.96 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.3599999999999999 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81000000000000005 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 1.73 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 4.5599999999999996 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 0.56999999999999995 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 2.8199999999999998 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 3.7599999999999998 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.3999999999999999 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68000000000000005 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt . . . . . 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 2.0899999999999999 111.398 -167.903 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.542 0.668 0 N-CA-C 113.746 1.017 . . . . 2.7999999999999998 113.746 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 2.3199999999999998 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.9300000000000002 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 1.29 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 1.4299999999999999 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 5.8099999999999996 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.2800000000000002 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 1.9399999999999999 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 2.6200000000000001 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 6.1299999999999999 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 0.98999999999999999 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt . . . . . 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.0299999999999998 110.548 171.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 CA--C 1.541 0.633 0 N-CA-C 114.773 1.398 . . . . 3.7200000000000002 114.773 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.3799999999999999 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.0099999999999998 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 . . . . . 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.8500000000000001 114.275 170.173 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 113.605 0.965 . . . . 1.28 113.605 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.5900000000000001 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 2.1400000000000001 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 0.75 113.783 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.1299999999999999 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.0600000000000001 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.3700000000000001 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.56000000000000005 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.47999999999999998 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 0.84999999999999998 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 1.6000000000000001 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 0.62 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 0.75 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 0.34000000000000002 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 1.97 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.1899999999999999 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.41999999999999998 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 2.1499999999999999 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 2.6299999999999999 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.79000000000000004 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.0900000000000001 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7000000000000002 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 40' ' ' SER . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 2.6000000000000001 109.239 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 1.78 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 0.89000000000000001 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.432 ' HB3' ' HB ' ' A' ' 37' ' ' ILE . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.3500000000000001 114.949 172.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.6299999999999999 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.58999999999999997 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 2.4199999999999999 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.3300000000000001 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.67000000000000004 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 2.2200000000000002 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 3.77 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 0.56000000000000005 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.02 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.1200000000000001 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.7400000000000002 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79000000000000004 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt . . . . . 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 2.3599999999999999 112.403 -167.033 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 2.73 113.311 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 2.0299999999999998 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.6800000000000002 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 1.1299999999999999 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.27 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 3.52 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.4100000000000001 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.1099999999999999 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 2.9900000000000002 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 6.5999999999999996 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 0.90000000000000002 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt . . . . . 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 4.1699999999999999 111.754 167.443 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 . . . . . 0 CA--C 1.544 0.741 0 N-CA-C 114.267 1.21 . . . . 3.46 114.267 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.6800000000000002 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 2.9100000000000001 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.55 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.3400000000000001 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 . . . . . 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.4100000000000001 111.281 172.093 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp . . . . . 0 N--CA 1.468 0.441 0 CA-C-O 117.559 -1.21 . . . . 1.8400000000000001 112.428 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.55 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.6399999999999999 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 2.25 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 0.73999999999999999 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.8900000000000001 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 1.1599999999999999 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.5800000000000001 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.29 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.64000000000000001 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.8100000000000001 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.3399999999999999 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 1.74 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.55 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 0.69999999999999996 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 0.55000000000000004 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 0.48999999999999999 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 2.1200000000000001 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.3500000000000001 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56000000000000005 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 2.2400000000000002 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 4.3899999999999997 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 2.71 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.95999999999999996 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 1.5700000000000001 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.9399999999999999 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.0099999999999998 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 2.6800000000000002 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.1599999999999999 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 1.98 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.3599999999999999 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.66000000000000003 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 1.77 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.2200000000000002 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.58999999999999997 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 2.4399999999999999 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 4.8300000000000001 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 0.58999999999999997 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 2.8999999999999999 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 2.9500000000000002 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.6400000000000001 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92000000000000004 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 2.5499999999999998 111.332 -176.232 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 118.902 -0.571 . . . . 2.5499999999999998 112.218 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 2.4900000000000002 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.8200000000000003 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 1.8200000000000001 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . 0.441 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.24 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 4.8399999999999999 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.1100000000000003 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 1.8500000000000001 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 6.5499999999999998 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 5.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.75 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 3.1400000000000001 111.525 176.167 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 . . . . . 0 N--CA 1.47 0.565 0 CA-C-O 122.696 1.236 . . . . 2.8799999999999999 112.995 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.454 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.4399999999999999 110.374 165.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 2.4500000000000002 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.514 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.4299999999999999 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 . . . . . 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.6499999999999999 114.222 -171.813 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 110.232 -0.284 . . . . 2.4199999999999999 110.232 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.5600000000000001 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 2.54 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.582 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 0.75 113.709 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.3600000000000001 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 0.82999999999999996 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.05 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65000000000000002 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.56999999999999995 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.8899999999999997 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 0.94999999999999996 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 2.02 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.582 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 0.73999999999999999 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.55000000000000004 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 0.28999999999999998 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 1.97 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 1.77 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.46999999999999997 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 2.0899999999999999 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 3.54 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 2.8999999999999999 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.96999999999999997 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 1.45 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.4900000000000002 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.3600000000000003 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.0499999999999998 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 2.2200000000000002 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 0.87 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.28 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.45000000000000001 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 1.9099999999999999 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.9199999999999999 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.55000000000000004 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 1.73 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 3.6699999999999999 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 0.47999999999999998 113.604 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 2.2999999999999998 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 3.7599999999999998 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.6899999999999999 115.592 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.68999999999999995 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt . . . . . 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 2.29 111.014 -167.312 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.311 2.5 pt? . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 2.7999999999999998 114.413 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 2.3599999999999999 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.6100000000000003 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 1.73 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.3700000000000001 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 3.4700000000000002 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.9500000000000002 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 2.77 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.0600000000000001 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 6.7599999999999998 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 1.5800000000000001 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp . . . . . 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 3.7999999999999998 110.145 168.554 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 . . . . . 0 CA--C 1.539 0.531 0 N-CA-C 114.041 1.126 . . . . 3.4300000000000002 114.041 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.442 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.1200000000000001 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.561 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.8700000000000001 113.588 -170.202 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp . . . . . 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 1.5 112.365 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.04 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.3400000000000001 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 2.1800000000000002 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 0.65000000000000002 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.1899999999999999 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 0.88 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 1.54 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.76000000000000001 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.70999999999999996 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.1099999999999999 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.81000000000000005 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 1.6799999999999999 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 0.55000000000000004 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.44 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 0.38 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 2.0099999999999998 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 1.73 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.40000000000000002 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 2.3100000000000001 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 2.8700000000000001 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 2.8500000000000001 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.72999999999999998 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 1.3600000000000001 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.0099999999999998 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 1.8100000000000001 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 1.8600000000000001 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 1.79 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.53 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.41999999999999998 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 1.7 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.4700000000000002 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.96999999999999997 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 1.74 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 5.3099999999999996 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 0.62 113.626 171.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 2.0499999999999998 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.1799999999999997 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79000000000000004 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp . . . . . 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 3.5299999999999998 110.722 -167.767 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 2.8500000000000001 114.943 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 1.9199999999999999 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.4399999999999999 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 1.3200000000000001 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 1.4299999999999999 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 4.9500000000000002 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.7300000000000004 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.0499999999999998 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 3.6899999999999999 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 7.9800000000000004 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 1.4299999999999999 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? . . . . . 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 3.5699999999999998 111.172 171.648 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 . . . . . 0 N--CA 1.446 -0.65 0 N-CA-C 113.274 0.842 . . . . 4.5199999999999996 113.274 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.5299999999999998 111.937 172.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.0099999999999998 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 . . . . . 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 118.018 -0.991 . . . . 1.79 113.406 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.3300000000000001 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 4.0899999999999999 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 1.0700000000000001 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.8600000000000001 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.1100000000000001 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.3100000000000001 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.0900000000000001 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.29 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.1200000000000001 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.0600000000000001 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 1.9299999999999999 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 0.96999999999999997 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 0.79000000000000004 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 0.31 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 2.0699999999999998 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 1.4099999999999999 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.57999999999999996 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 2.2400000000000002 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 2.7599999999999998 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 3.02 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 1.79 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.7799999999999998 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.6099999999999999 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 1.71 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 1.6599999999999999 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 42' ' ' CYS . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.03 115.808 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.3700000000000001 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.3700000000000001 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.403 ' HB2' ' HA2' ' A' ' 39' ' ' GLY . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.53000000000000003 114.561 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 1.8100000000000001 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.2400000000000002 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.68999999999999995 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 1.8899999999999999 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 5.5099999999999998 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 0.89000000000000001 113.351 167.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 3.5299999999999998 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 3.8900000000000001 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.90000000000000002 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp . . . . . 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 4.7199999999999998 111.269 -170.607 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 3.6200000000000001 114.281 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 3.7999999999999998 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.3600000000000003 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 2.3500000000000001 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 2.98 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.0 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.7200000000000002 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 1.6799999999999999 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 3.7999999999999998 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 7.0800000000000001 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 1.75 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 4.0499999999999998 110.771 171.976 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 . . . . . 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.2599999999999998 114.46 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.57 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.5499999999999998 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 3.0899999999999999 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CE3' HG21 ' A' ' 4' ' ' ILE . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.6899999999999999 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 . . . . . 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.6800000000000002 113.567 174.745 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.45 HD22 ' CG2' ' A' ' 4' ' ' ILE . 8.0 mp . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 112.544 0.572 . . . . 1.3400000000000001 112.544 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 2.6299999999999999 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 0.83999999999999997 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.3400000000000001 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 0.85999999999999999 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.24 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.76000000000000001 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.68999999999999995 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.0899999999999999 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.1200000000000001 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 1.8899999999999999 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 0.83999999999999997 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 0.84999999999999998 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 0.31 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 2.7799999999999998 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 1.78 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.42999999999999999 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 1.95 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 3.4300000000000002 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 2.46 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.60999999999999999 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 1.25 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.8799999999999999 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1000000000000001 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 1.77 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 1.5700000000000001 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.3600000000000001 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.9100000000000001 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.1800000000000002 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.51000000000000001 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 1.46 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.8400000000000001 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.73999999999999999 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 2.02 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 4.4100000000000001 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 0.70999999999999996 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 2.5899999999999999 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 3.5800000000000001 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.6699999999999999 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.96999999999999997 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt . . . . . 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.0600000000000001 111.832 -168.227 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 2.4199999999999999 115.009 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 2.6299999999999999 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.0800000000000001 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 1.6899999999999999 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.24 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 4.71 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.0199999999999996 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 2.3900000000000001 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 4.04 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 6.46 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.29 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 4.3499999999999996 111.756 170.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 . . . . . 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.46 116.694 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.3199999999999998 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.1400000000000001 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 . . . . . 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.3100000000000001 113.426 -176.056 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 114.301 1.223 . . . . 1.73 114.301 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.4099999999999999 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.6399999999999999 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 2.02 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 0.79000000000000004 115.095 -167.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.24 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.71999999999999997 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 0.95999999999999996 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56000000000000005 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.51000000000000001 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.8199999999999998 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.68000000000000005 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.414 ' HD2' ' HB2' ' A' ' 15' ' ' ALA . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 1.79 112.854 169.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 0.84999999999999998 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.56000000000000005 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 0.33000000000000002 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 2.02 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 1.8700000000000001 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.41999999999999998 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.436 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 2.7000000000000002 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.0600000000000001 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 2.4399999999999999 113.339 162.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.60999999999999999 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 1.0900000000000001 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.2599999999999998 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.6699999999999999 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 3.6299999999999999 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 2.8199999999999998 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.3899999999999999 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.4500000000000002 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.4700000000000002 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.54000000000000004 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 1.5 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.8999999999999999 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76000000000000001 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 2.02 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 3.73 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 0.55000000000000004 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 2.4399999999999999 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.1600000000000001 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.5499999999999998 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66000000000000003 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 2.2999999999999998 111.933 -168.503 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt . . . . . 0 N--CA 1.468 0.475 0 CA-C-O 118.174 -0.917 . . . . 2.8399999999999999 110.872 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 2.9399999999999999 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.1399999999999997 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 1.3500000000000001 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.1899999999999999 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 4.54 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.9400000000000004 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.0 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 3.3100000000000001 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 7.7699999999999996 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 1.0600000000000001 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp . . . . . 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 3.3300000000000001 110.621 174.969 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 116.396 1.999 . . . . 4.8799999999999999 116.396 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.5600000000000001 111.815 170.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.0899999999999999 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.3500000000000001 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 113.301 175.743 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt . . . . . 0 N--CA 1.467 0.381 0 N-CA-C 109.905 -0.406 . . . . 1.95 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.53 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.28 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 2.2599999999999998 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.3600000000000001 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.3600000000000001 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.1499999999999999 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 1.49 115.635 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.1599999999999999 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 0.95999999999999996 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.3900000000000001 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.1499999999999999 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 1.5700000000000001 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 0.59999999999999998 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.46999999999999997 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 0.34999999999999998 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 2.1800000000000002 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.3799999999999999 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.47999999999999998 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 3.5600000000000001 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 3.6299999999999999 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 2.7799999999999998 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.77000000000000002 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 1.25 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.8300000000000001 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 2.6699999999999999 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 2.4700000000000002 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.25 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.51 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.40999999999999998 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 1.47 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.0800000000000001 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67000000000000004 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 1.77 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 3.52 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 0.53000000000000003 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 2.3799999999999999 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 3.2200000000000002 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.9100000000000001 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm . . . . . 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 4.5 111.839 -169.634 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 4.6600000000000001 115.285 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 2.5499999999999998 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.2599999999999998 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 1.3600000000000001 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 1.6899999999999999 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 4.5300000000000002 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.3700000000000001 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 1.9199999999999999 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 3.3999999999999999 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 5.4100000000000001 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 0.96999999999999997 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt . . . . . 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 3.8599999999999999 110.85 174.824 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 . . . . . 0 CA--C 1.541 0.601 0 CA-C-O 122.324 1.059 . . . . 3.23 112.284 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.5499999999999998 111.105 177.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 3.46 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.607 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.5899999999999999 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 . . . . . 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.5099999999999998 115.389 -151.325 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.539 HD23 ' CE2' ' A' ' 23' ' ' PHE . 8.7 mp . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 114.06 1.133 . . . . 1.8799999999999999 114.06 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.3199999999999998 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.8999999999999999 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.408 ' HG2' ' CZ ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 2.48 114.782 -175.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.1699999999999999 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.8200000000000001 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.3500000000000001 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 1.6000000000000001 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 0.96999999999999997 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.63 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.539 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 2.1400000000000001 112.357 168.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 0.89000000000000001 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.60999999999999999 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 0.39000000000000001 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.407 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 2.1099999999999999 113.151 -178.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 1.74 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51000000000000001 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 2.4100000000000001 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 2.79 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 2.5499999999999998 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.93000000000000005 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 1.45 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.9500000000000002 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.0800000000000001 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 1.6200000000000001 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 1.6799999999999999 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 1.4399999999999999 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.6799999999999999 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.1099999999999999 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.53000000000000003 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 1.48 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.3300000000000001 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.64000000000000001 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 1.8400000000000001 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 4.1500000000000004 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 0.95999999999999996 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 3.52 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 3.6899999999999999 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.5099999999999998 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt . . . . . 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 1.99 111.923 -169.967 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.968 1.099 . . . . 3.5899999999999999 113.968 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 3.1099999999999999 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.3200000000000003 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 1.6799999999999999 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 2.77 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.2199999999999998 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.0300000000000002 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.25 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 3.3700000000000001 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 9.2599999999999998 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 1.9299999999999999 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt . . . . . 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 3.7999999999999998 111.563 176.354 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 122.219 1.009 . . . . 3.1000000000000001 113.502 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.531 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.1099999999999999 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.554 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.3400000000000001 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.3100000000000001 112.442 168.72 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 118.657 -0.687 . . . . 1.26 112.341 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.1399999999999999 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.4099999999999999 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.466 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.3900000000000001 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 0.93000000000000005 113.445 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.0800000000000001 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.69999999999999996 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.03 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55000000000000004 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.68999999999999995 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.8300000000000001 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 0.69999999999999996 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.466 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 1.6100000000000001 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 0.67000000000000004 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 0.70999999999999996 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 0.32000000000000001 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 2.1000000000000001 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.3200000000000001 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.40999999999999998 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 2.7000000000000002 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 2.7200000000000002 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 2.25 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.66000000000000003 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 1.1299999999999999 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.5299999999999998 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.9399999999999999 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 2.1499999999999999 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 1.76 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.29 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 1.51 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.7599999999999998 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.64000000000000001 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 1.3500000000000001 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.8200000000000001 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.57999999999999996 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 1.6899999999999999 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 3.9100000000000001 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 0.56000000000000005 112.231 172.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 2.5899999999999999 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.25 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.70999999999999996 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.0499999999999998 112.229 -168.24 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? . . . . . 0 N--CA 1.472 0.652 0 CA-C-O 118.229 -0.891 . . . . 2.5099999999999998 113.361 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 2.3599999999999999 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.5 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 1.48 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 1.3700000000000001 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 4.5 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.5600000000000001 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 1.6599999999999999 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 2.6099999999999999 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 5.2699999999999996 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 0.89000000000000001 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt . . . . . 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 3.29 111.892 177.213 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 . . . . . 0 N--CA 1.468 0.435 0 N-CA-C 114.007 1.114 . . . . 2.9700000000000002 114.007 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.469 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.9500000000000002 112.803 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.46 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.485 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 . . . . . 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.29 113.008 167.677 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt . . . . . 0 CA--C 1.544 0.724 0 N-CA-C 110.553 -0.166 . . . . 2.3399999999999999 110.553 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.6299999999999999 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 1.76 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.501 ' HB1' ' CE ' ' A' ' 24' ' ' LYS 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 0.90000000000000002 114.814 -172.615 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.29 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 0.80000000000000004 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.3799999999999999 114.525 166.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81000000000000005 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.60999999999999999 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.8099999999999996 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 0.81999999999999995 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 1.95 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.501 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 0.57999999999999996 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.48999999999999999 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 0.31 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 1.97 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.3500000000000001 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.40999999999999998 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 2.6899999999999999 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 2.71 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 2.3999999999999999 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.67000000000000004 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 1.0900000000000001 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.6200000000000001 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.8500000000000001 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 1.8999999999999999 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 1.8100000000000001 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.3700000000000001 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.4399999999999999 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.9700000000000002 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.69999999999999996 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 2.1099999999999999 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.1200000000000001 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 1.72 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 5.6399999999999997 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 0.63 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 2.3300000000000001 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.0499999999999998 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.0600000000000001 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.68999999999999995 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt . . . . . 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.0 112.078 -168.864 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 N--CA 1.476 0.863 0 N-CA-C 113.272 0.841 . . . . 3.0600000000000001 113.272 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 1.8 114.833 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 1.25 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.24 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 5.2199999999999998 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.4699999999999998 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 1.53 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 3.3900000000000001 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 5.4800000000000004 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.0900000000000001 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt . . . . . 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 4.1299999999999999 112.13 174.072 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 CA--C 1.542 0.665 0 N-CA-C 113.447 0.906 . . . . 3.75 113.447 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.459 HD12 ' H ' ' A' ' 4' ' ' ILE . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.0099999999999998 110.334 162.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.0899999999999999 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.533 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.3100000000000001 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.0499999999999998 110.183 -174.204 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt . . . . . 0 CA--C 1.544 0.728 0 N-CA-C 110.666 -0.124 . . . . 1.8300000000000001 110.666 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.3200000000000001 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.3600000000000001 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 1.75 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 0.72999999999999998 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 0.73999999999999999 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 1.47 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.64000000000000001 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.47999999999999998 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.0300000000000002 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.79000000000000004 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 2.2999999999999998 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 1.0900000000000001 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.5 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 0.33000000000000002 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 2.1400000000000001 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.24 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53000000000000003 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 2.3500000000000001 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 2.6200000000000001 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 2.1600000000000001 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.1599999999999999 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 1.3600000000000001 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.1400000000000001 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.3199999999999998 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 1.8400000000000001 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 1.95 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.28 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.53 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2000000000000002 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.59999999999999998 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 1.9299999999999999 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.5699999999999998 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.58999999999999997 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 2.1000000000000001 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 3.5600000000000001 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 0.51000000000000001 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 2.6000000000000001 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 3.1699999999999999 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.4300000000000002 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64000000000000001 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp . . . . . 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 3.23 111.655 -170.015 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 3.4199999999999999 114.209 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 2.5299999999999998 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.9199999999999999 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 1.26 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.3100000000000001 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 3.48 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.7599999999999998 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 1.9099999999999999 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 2.6099999999999999 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 4.7300000000000004 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 0.93999999999999995 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.0099999999999998 110.439 167.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 . . . . . 0 CA--C 1.551 0.999 0 N-CA-C 113.395 0.887 . . . . 3.5499999999999998 113.395 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 11' ' ' LEU . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.9100000000000001 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.613 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 . . . . . 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -169.331 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 4' ' ' ILE . 4.5 mp . . . . . 0 CA--C 1.544 0.735 0 CA-C-O 118.403 -0.808 . . . . 1.23 111.782 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.49 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6000000000000001 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 2.2599999999999998 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 0.68999999999999995 113.884 -166.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.3799999999999999 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.72999999999999998 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 0.94999999999999996 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81000000000000005 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.44 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.2799999999999998 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.0600000000000001 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.617 ' CE2' HD23 ' A' ' 11' ' ' LEU . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 2.27 112.662 172.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 0.65000000000000002 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 0.88 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 0.33000000000000002 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.419 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 2.0600000000000001 112.632 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 1.53 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.59999999999999998 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 2.3900000000000001 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 2.5600000000000001 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 2.8100000000000001 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 0.89000000000000001 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 1.3300000000000001 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6000000000000001 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.9500000000000002 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 1.6299999999999999 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 1.8100000000000001 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.5 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 1.71 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.9199999999999999 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.69999999999999996 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 2.5600000000000001 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.7799999999999998 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.0700000000000001 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 2.3599999999999999 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 4.3200000000000003 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 0.90000000000000002 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 2.7799999999999998 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 3.29 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.3500000000000001 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.96999999999999997 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt . . . . . 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.04 112.224 -171.102 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 114.853 1.427 . . . . 2.73 114.853 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 2.5 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 1.5600000000000001 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.3200000000000001 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 4.9400000000000004 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 1.6299999999999999 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 2.8599999999999999 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 5.25 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 1.28 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 4.7599999999999998 111.729 179.353 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 115.743 1.757 . . . . 2.8399999999999999 115.743 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.8500000000000001 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.3599999999999999 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 2.8799999999999999 113.128 -163.778 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 CA--C 1.546 0.795 0 CA-C-O 119.511 -0.28 . . . . 1.6899999999999999 110.835 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.3799999999999999 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.24 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 2.0699999999999998 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 0.90000000000000002 113.369 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.1100000000000001 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.69999999999999996 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.03 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.73999999999999999 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.46999999999999997 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.0800000000000001 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.68000000000000005 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 2.2000000000000002 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 0.71999999999999997 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 0.71999999999999997 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 0.31 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 1.98 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 1.5700000000000001 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45000000000000001 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 2.4500000000000002 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 2.7599999999999998 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 2.5899999999999999 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 0.81000000000000005 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 1.25 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.4100000000000001 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.3300000000000001 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 1.8600000000000001 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 2.0600000000000001 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.1399999999999999 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.3300000000000001 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.1699999999999999 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.42999999999999999 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 2.1600000000000001 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.8999999999999999 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89000000000000001 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 1.78 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.0300000000000002 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 0.68999999999999995 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 2.6600000000000001 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 4.6699999999999999 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.7400000000000002 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.73999999999999999 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt . . . . . 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 2.48 111.414 -169.635 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 3.8599999999999999 115.496 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 3.1299999999999999 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.8399999999999999 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 1.3 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.27 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 4.9000000000000004 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.4800000000000004 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 1.6899999999999999 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 3.7599999999999998 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 5.9400000000000004 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 1.3300000000000001 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt . . . . . 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 3.6899999999999999 111.282 171.915 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 44.3 t-20 . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 118.917 -0.563 . . . . 5.4500000000000002 111.768 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.08 24.07 30.57 Favored Glycine 0 CA--C 1.538 1.52 0 C-N-CA 124.335 0.969 . . . . 2.1899999999999999 114.494 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -72.33 165.79 23.78 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.821 2.048 . . . . 3.3199999999999998 114.754 -173.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.8 mp -77.28 -39.17 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 125.183 1.393 . . . . 2.1299999999999999 113.86 -167.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 66.44 90.38 0.09 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.865 1.666 . . . . 2.6600000000000001 112.222 -166.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 78.0 m95 -79.04 6.32 9.69 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 115.704 1.742 . . . . 1.22 115.704 -156.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -74.37 -14.23 60.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.507 1.523 . . . . 2.3100000000000001 113.382 172.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 72.4 m -54.08 127.27 54.5 Favored Pre-proline 0 N--CA 1.473 0.702 0 C-N-CA 125.297 1.439 . . . . 5.2300000000000004 112.514 178.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -58.06 139.13 89.33 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.94 2.426 . . . . 4.4000000000000004 114.782 -172.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m 65.49 -33.58 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.922 2.489 . . . . 5.8200000000000003 115.901 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 tt -60.83 -46.2 91.5 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 120.355 1.434 . . . . 2.0 109.366 159.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.22 -37.25 64.02 Favored Glycine 0 CA--C 1.537 1.428 0 CA-C-N 119.21 0.914 . . . . 1.24 113.343 172.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.62 -17.03 66.39 Favored Glycine 0 CA--C 1.539 1.586 0 C-N-CA 125.383 1.468 . . . . 1.1899999999999999 115.582 172.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 33.5 mtp -97.67 -31.43 12.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.2 1.5 . . . . 1.73 112.763 166.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.72 30.48 0.09 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 125.639 1.576 . . . . 0.92000000000000004 112.784 170.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.0 m -144.3 171.3 14.51 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 128.604 2.762 . . . . 1.25 110.799 -175.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 84.96 -174.74 49.85 Favored Glycine 0 CA--C 1.538 1.517 0 O-C-N 121.37 -0.832 . . . . 0.80000000000000004 113.845 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -37.89 -43.8 1.62 Allowed 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.697 3.598 . . . . 1.03 116.091 165.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.4 m -105.22 14.42 29.06 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.842 0.857 . . . . 0.97999999999999998 113.161 -167.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.02 -44.59 94.54 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.501 -1.04 . . . . 0.51000000000000001 110.501 -169.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -59.99 -29.5 68.5 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.256 1.423 . . . . 3.2200000000000002 113.835 175.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -69.15 -34.45 75.02 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 118.902 0.774 . . . . 0.70999999999999996 109.499 174.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.7 t80 -68.98 -46.26 68.54 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 118.126 0.421 . . . . 2.6400000000000001 111.172 171.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.1 mmtp -52.73 -52.45 56.25 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.366 0.666 . . . . 0.92000000000000004 110.586 175.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 10.7 t -68.78 -43.18 76.27 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 126.088 1.755 . . . . 0.5 112.34 -174.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.36 -55.38 16.19 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.193 0.997 . . . . 0.28000000000000003 112.713 176.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.77 -31.42 66.61 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 118.72 -0.657 . . . . 2.0899999999999999 112.335 -174.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.3 p -67.9 -45.94 73.01 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.672 1.123 . . . . 1.3100000000000001 112.052 168.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.7 t -55.33 -39.97 70.64 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 120.082 1.31 . . . . 0.46999999999999997 112.253 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.426 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 1.9 t80 -65.6 -50.86 63.54 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.257 1.023 . . . . 2.27 112.936 171.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -66.9 -27.5 67.55 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 119.265 0.939 . . . . 3.02 112.491 -176.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -70.05 -24.09 63.2 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 121.215 -0.928 . . . . 2.79 111.75 171.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.3 t -94.37 -58.86 2.09 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.866 1.666 . . . . 1.0600000000000001 115.157 -172.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 60.6 p 43.36 34.15 0.7 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 127.773 2.429 . . . . 1.3999999999999999 116.405 -171.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -57.4 -63.58 1.18 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.017 1.727 . . . . 2.75 114.386 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -167.96 -42.66 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.454 1.102 . . . . 2.8999999999999999 113.393 -168.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.5 mt -129.72 150.53 34.71 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 127.072 2.149 . . . . 1.52 109.737 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 0.1 OUTLIER -50.22 100.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 124.465 1.106 . . . . 1.5600000000000001 110.639 170.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.15 29.48 64.48 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-O 118.109 -1.384 . . . . 0.87 116.094 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 99.7 p -48.07 -28.43 2.86 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 119.539 1.669 . . . . 1.72 115.447 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -110.09 11.5 23.8 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 128.793 2.837 . . . . 4.04 113.942 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 93.5 m -138.08 14.17 2.85 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 125.362 1.465 . . . . 0.60999999999999999 112.403 -162.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.7 m -61.66 -27.83 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.792 0.664 . . . . 1.8 112.792 -159.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -59.55 -33.32 71.27 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.932 1.293 . . . . 2.1499999999999999 114.073 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -69.66 -45.23 68.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 119.126 0.875 . . . . 0.68999999999999995 111.394 175.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.9 m-85 -69.02 -35.9 77.17 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 121.102 -0.999 . . . . 1.6599999999999999 111.221 176.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -61.81 -43.15 99.42 Favored 'General case' 0 C--O 1.224 -0.242 0 C-N-CA 124.193 0.997 . . . . 4.1299999999999999 111.485 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.24 83.04 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 112.484 0.549 . . . . 0.71999999999999997 112.484 172.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 37.1 ttp -64.2 -42.9 96.42 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.38 -0.825 . . . . 2.3700000000000001 112.149 174.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -59.66 -58.92 6.49 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.789 0.722 . . . . 4.0300000000000002 111.139 168.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -51.25 -27.08 8.28 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 127.884 2.474 . . . . 2.27 115.144 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 38.2 t -87.66 -46.26 9.67 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.81 1.244 . . . . 1.0700000000000001 111.895 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 60.4 mtt -80.91 -20.0 43.1 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 120.666 -1.271 . . . . 2.1800000000000002 111.262 -170.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -66.09 -19.85 65.98 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.903 1.681 . . . . 2.1899999999999999 112.487 172.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -79.53 -27.08 41.34 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.861 1.265 . . . . 3.4199999999999999 113.853 168.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -132.83 102.65 13.44 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 123.499 0.719 . . . . 2.7400000000000002 112.87 -164.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.18 -50.87 0.08 OUTLIER 'Trans proline' 0 CA--C 1.54 0.781 0 C-N-CA 122.447 2.098 . . . . 2.6499999999999999 112.444 -173.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -159.23 54.67 0.4 Allowed 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 123.92 1.819 . . . . 4.71 111.439 -169.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.444 ' O ' HD22 ' A' ' 59' ' ' LEU . 0.6 OUTLIER -109.24 -10.17 14.97 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 128.413 2.685 . . . . 1.9199999999999999 111.996 -155.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 15.6 p90 . . . . . 0 C--O 1.253 1.261 0 C-N-CA 128.232 2.613 . . . . 2.7999999999999998 111.945 -165.36 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 112.151 0.426 . . . . 12.220000000000001 112.151 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 -68.09 166.78 15.34 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.526 1.53 . . . . 9.7599999999999998 112.713 174.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.2 t -95.69 127.67 41.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 5.1200000000000001 111.546 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 74.33 72.76 0.98 Allowed Glycine 0 CA--C 1.534 1.26 0 N-CA-C 115.698 1.039 . . . . 3.6499999999999999 115.698 171.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -76.5 -16.5 59.63 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.617 1.34 . . . . 7.2599999999999998 114.617 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 69.7 mt -109.09 -0.99 19.15 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 126.126 1.77 . . . . 3.8300000000000001 113.127 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.28 -34.33 58.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.962 1.705 . . . . 2.2999999999999998 114.628 -163.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.2 mp0 -64.45 -42.23 96.08 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.114 -0.991 . . . . 3.8199999999999998 110.218 171.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.37 -32.81 74.65 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 117.659 -1.162 . . . . 1.3100000000000001 112.431 173.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -57.98 -60.36 3.84 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 121.037 1.744 . . . . 1.22 110.349 170.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -60.35 -47.49 85.84 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.021 1.328 . . . . 4.1900000000000004 112.364 -176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -77.61 -28.64 51.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 117.491 -1.242 . . . . 5.9000000000000004 113.454 -175.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.0 m -70.22 -42.66 71.98 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 120.143 1.338 . . . . 1.51 111.182 169.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.6 ptm -65.92 -30.78 71.42 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 119.631 1.105 . . . . 2.9199999999999999 112.785 175.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 49.0 ttm-85 -67.12 -47.62 70.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 119.218 0.917 . . . . 5.9500000000000002 112.585 169.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.71 -41.14 97.21 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.812 0.845 . . . . 0.96999999999999997 112.128 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.5 tt -68.5 -36.55 79.06 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.555 1.542 . . . . 3.2599999999999998 111.485 171.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.41 -32.71 61.04 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 125.707 1.622 . . . . 1.75 114.041 169.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -84.86 -37.43 20.68 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 118.732 1.266 . . . . 5.3099999999999996 113.484 170.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 30.1 ttmt -80.54 -33.61 36.12 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.915 1.45 . . . . 3.6099999999999999 114.915 -169.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 42.6 mm . . . . . 0 C--O 1.256 1.414 0 C-N-CA 124.94 1.296 . . . . 5.0199999999999996 111.25 -178.124 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 118.565 -0.731 . . . . 3.9199999999999999 111.214 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.48 27.69 70.89 Favored Glycine 0 CA--C 1.536 1.392 0 CA-C-N 119.87 1.214 . . . . 2.2400000000000002 113.401 -175.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -72.58 162.01 30.03 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 127.563 2.345 . . . . 3.6499999999999999 112.615 -179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.447 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.8 mp -71.42 -43.95 72.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 124.066 0.946 . . . . 2.4399999999999999 112.491 177.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 66.21 85.51 0.14 Allowed 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.224 1.41 . . . . 1.96 111.999 -159.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.515 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.7 m95 -74.08 -13.29 60.82 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.248 2.219 . . . . 1.25 112.798 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -57.51 142.69 43.42 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.718 1.207 . . . . 2.7200000000000002 111.269 168.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.5 m 58.68 160.91 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 127.101 2.161 . . . . 5.21 114.964 -175.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -75.2 22.38 0.43 Allowed 'Trans proline' 0 CA--C 1.547 1.134 0 N-CA-C 118.73 2.55 . . . . 4.9000000000000004 118.73 -154.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -71.15 -60.31 2.3 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 119.751 1.16 . . . . 4.3399999999999999 112.868 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.403 HD23 ' CE2' ' A' ' 23' ' ' PHE . 6.3 mp -110.24 -13.63 14.3 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.298 1.039 . . . . 1.4099999999999999 111.76 166.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -45.05 -45.84 9.62 Favored Glycine 0 CA--C 1.532 1.106 0 C-N-CA 125.086 1.327 . . . . 1.23 115.893 -163.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.03 -35.45 64.59 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 125.309 1.433 . . . . 1.24 114.74 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.8 tpt -70.14 -35.37 74.01 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.385 1.093 . . . . 2.27 111.045 172.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -83.39 1.97 38.8 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 126.888 2.075 . . . . 0.67000000000000004 114.592 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.1 m -98.16 175.26 6.15 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.975 1.71 . . . . 1.1399999999999999 111.363 170.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.51 175.13 40.23 Favored Glycine 0 CA--C 1.535 1.302 0 N-CA-C 115.573 0.989 . . . . 0.67000000000000004 115.573 171.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -35.36 -45.55 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.573 1 C-N-CA 126.102 4.535 . . . . 0.88 116.114 164.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.7 m -106.18 16.83 24.38 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.437 1.495 . . . . 0.60999999999999999 112.801 -173.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -44.77 93.49 Favored Glycine 0 CA--C 1.524 0.656 0 N-CA-C 110.996 -0.841 . . . . 0.46000000000000002 110.996 -169.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -58.25 -30.73 66.77 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.304 1.841 . . . . 2.9399999999999999 113.345 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -65.34 -36.07 82.91 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 118.948 0.794 . . . . 0.80000000000000004 109.994 173.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.403 ' CE2' HD23 ' A' ' 11' ' ' LEU . 3.4 t80 -70.74 -44.93 65.8 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.209 0.818 . . . . 2.3199999999999998 113.209 171.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 29.7 mmtp -53.31 -51.18 63.18 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.318 0.647 . . . . 0.62 109.836 176.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.7 t -63.48 -48.68 76.64 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.511 1.925 . . . . 0.42999999999999999 112.9 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.31 -52.05 51.2 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 120.894 -1.129 . . . . 0.33000000000000002 113.279 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -75.28 -28.24 59.69 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-O 118.633 -0.699 . . . . 2.7200000000000002 111.727 -177.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.7 m -63.42 -46.43 86.37 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 119.919 1.236 . . . . 2.0600000000000001 111.361 166.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.2 t -57.77 -39.37 77.3 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.328 0.967 . . . . 0.47999999999999998 110.894 175.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -65.7 -38.94 90.62 Favored 'General case' 0 CA--C 1.548 0.875 0 O-C-N 120.82 -1.175 . . . . 2.0699999999999998 113.77 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -62.06 -37.06 83.56 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-N 119.815 1.188 . . . . 2.8100000000000001 112.201 171.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -82.11 -2.68 52.79 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 114.29 1.218 . . . . 2.3199999999999998 114.29 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.8 t -96.71 -70.81 0.7 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.994 1.318 . . . . 0.83999999999999997 111.913 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 63.4 p 47.06 48.48 15.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.668 1.187 . . . . 1.25 112.968 -170.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -84.22 -77.54 0.26 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.65 1.18 . . . . 3.0600000000000001 112.895 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -156.57 -41.88 0.07 Allowed 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.455 1.102 . . . . 2.6800000000000002 113.313 -170.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 45.3 mt -123.26 164.84 20.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 125.607 1.563 . . . . 1.6100000000000001 110.026 -177.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.68 100.75 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 120.312 1.415 . . . . 2.0299999999999998 109.763 172.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.87 42.38 99.69 Favored Glycine 0 CA--C 1.537 1.431 0 N-CA-C 116.247 1.259 . . . . 1.0 116.247 175.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 21.3 p -62.89 -7.61 5.47 Favored 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 116.901 2.186 . . . . 1.5900000000000001 116.901 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -115.77 8.66 14.93 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 126.111 1.764 . . . . 2.1800000000000002 112.657 167.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 92.6 m -128.57 3.41 5.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.782 2.033 . . . . 0.60999999999999999 113.794 -167.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.8 p -59.26 -25.39 30.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 113.634 0.975 . . . . 1.72 113.634 -165.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -60.56 -37.36 81.01 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 119.594 1.088 . . . . 2.48 112.604 173.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -67.37 -38.52 84.91 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.613 -1.304 . . . . 0.78000000000000003 111.138 174.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -70.86 -32.85 69.98 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 120.944 -1.097 . . . . 2.0299999999999998 111.77 173.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.3 ttp-105 -61.82 -41.71 98.12 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.045 0.938 . . . . 4.3099999999999996 110.812 173.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.87 90.82 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.245 0.831 . . . . 0.71999999999999997 113.245 170.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 16.1 ttm -54.75 -51.75 64.68 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.689 -0.632 . . . . 2.98 111.674 174.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -66.52 -49.48 66.37 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.135 0.574 . . . . 2.98 111.603 179.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -53.63 -29.27 37.26 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 126.6 1.96 . . . . 4.1200000000000001 114.739 174.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 19.6 t -89.67 -38.45 13.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.353 0.661 . . . . 1.21 111.546 174.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.3 mtt -84.87 -8.82 58.63 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.149 -1.595 . . . . 2.3100000000000001 112.438 -172.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -71.46 -23.75 61.89 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.938 1.695 . . . . 2.23 112.751 163.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -70.93 -48.65 52.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.13 0.972 . . . . 3.2599999999999998 110.98 169.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.445 ' HB3' ' CG ' ' A' ' 59' ' ' LEU . 8.4 m-85 -127.28 95.68 35.59 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 125.993 1.717 . . . . 2.4399999999999999 109.334 -168.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -76.53 -35.29 2.18 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 124.026 3.15 . . . . 4.0099999999999998 115.06 -161.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -149.62 -2.52 0.42 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.578 1.151 . . . . 6.0599999999999996 113.194 -166.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.445 ' CG ' ' HB3' ' A' ' 56' ' ' TYR . 0.2 OUTLIER -85.73 12.09 9.67 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 115.208 1.559 . . . . 3.3300000000000001 115.208 -142.065 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.428 0 C-N-CA 127.487 2.315 . . . . 3.5600000000000001 114.595 -157.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.949 -0.389 . . . . 11.67 109.949 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -67.96 161.94 25.45 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.522 0.564 . . . . 10.08 112.522 -178.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 66.09 -39.06 0.31 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 126.936 2.094 . . . . 4.7300000000000004 114.407 -175.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.68 14.99 0.68 Allowed Glycine 0 CA--C 1.535 1.31 0 N-CA-C 118.632 2.213 . . . . 4.0899999999999999 118.632 -167.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 24.6 p-80 -50.54 -30.92 14.22 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 121.232 2.516 . . . . 6.1699999999999999 114.99 178.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.75 HD23 ' H ' ' B' ' 66' ' ' LEU 0.252 0.6 OUTLIER -79.93 -19.9 46.94 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 115.315 1.598 . . . . 3.0800000000000001 115.315 176.489 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 24.9 mm -56.81 -49.24 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 CA-C-N 120.923 1.692 . . . . 3.6899999999999999 112.709 -176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.86 -38.16 90.05 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.318 -0.864 . . . . 4.5199999999999996 111.988 179.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.01 -31.13 68.64 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.704 0.802 . . . . 2.1099999999999999 112.525 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -64.12 -49.98 70.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.669 0.787 . . . . 1.48 111.105 170.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -60.09 -48.77 80.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.281 0.632 . . . . 5.6799999999999997 111.19 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.35 -38.66 88.14 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.383 0.883 . . . . 6.3600000000000003 113.383 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -68.51 -42.89 77.91 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.707 0.685 . . . . 1.98 112.478 176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -33.53 72.06 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.078 0.854 . . . . 3.0800000000000001 112.41 177.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -61.42 -47.3 86.38 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 118.812 0.733 . . . . 7.9500000000000002 111.794 169.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.63 -43.82 93.69 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.157 0.583 . . . . 1.4299999999999999 111.904 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 89.9 mt -63.47 -39.35 94.24 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.922 0.889 . . . . 3.3999999999999999 112.441 173.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.09 -44.42 88.43 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.076 0.846 . . . . 2.1800000000000002 112.803 172.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -72.14 -27.47 62.63 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.53 0.937 . . . . 6.3200000000000003 113.53 171.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.3 tttm -68.58 -50.52 51.08 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.966 1.307 . . . . 3.79 112.79 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 45.4 mm . . . . . 0 C--O 1.254 1.33 0 C-N-CA 124.624 1.17 . . . . 4.6500000000000004 112.653 -168.91 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 . . . . . 0 N--CA 1.475 0.785 0 CA-C-O 117.767 -1.111 . . . . 7.2300000000000004 111.915 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.83 15.39 41.7 Favored Glycine 0 CA--C 1.535 1.311 0 CA-C-N 120.254 1.388 . . . . 5.79 115.757 -173.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -76.97 162.54 27.49 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.756 1.278 . . . . 3.8700000000000001 112.862 -175.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE3' ' A' ' 6' ' ' TRP . 0.1 OUTLIER -48.53 -24.3 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.083 0 C-N-CA 129.109 2.964 . . . . 2.4900000000000002 114.481 171.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 64.6 74.5 0.4 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 128.313 2.645 . . . . 2.3999999999999999 112.522 -166.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.632 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 60.5 m95 -58.16 -27.71 64.07 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.076 1.139 . . . . 1.5600000000000001 114.076 -176.661 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -68.32 -20.24 64.73 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 127.105 2.162 . . . . 2.3799999999999999 114.212 174.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 91.4 p -66.31 146.67 99.05 Favored Pre-proline 0 CA--C 1.541 0.611 0 O-C-N 121.316 -0.865 . . . . 4.7599999999999998 111.628 177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -62.88 -8.93 14.84 Favored 'Trans proline' 0 CA--C 1.54 0.825 0 C-N-CA 123.242 2.628 . . . . 4.4900000000000002 113.135 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.3 m -58.59 -51.93 67.81 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.748 2.019 . . . . 5.1399999999999997 112.432 171.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 mp -111.87 -15.14 13.42 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.298 1.439 . . . . 1.49 113.934 -178.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -50.14 -44.91 43.15 Favored Glycine 0 CA--C 1.537 1.407 0 N-CA-C 116.06 1.184 . . . . 1.5600000000000001 116.06 -162.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -64.67 -17.07 62.06 Favored Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.872 1.109 . . . . 1.99 115.872 176.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.7 mmt -100.53 -50.36 3.92 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.921 1.688 . . . . 2.6200000000000001 112.372 177.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.3 -4.57 30.47 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 114.891 1.441 . . . . 0.71999999999999997 114.891 -177.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.2 m -81.22 178.12 8.59 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.789 1.636 . . . . 1.6899999999999999 112.147 164.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 92.68 174.09 41.35 Favored Glycine 0 CA--C 1.543 1.801 0 O-C-N 120.602 -1.311 . . . . 0.90000000000000002 116.181 167.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 33.2 Cg_endo -51.15 -18.89 5.32 Favored 'Trans proline' 0 C--N 1.35 0.609 1 C-N-CA 127.008 5.139 . . . . 1.25 116.811 175.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 33.9 m -126.05 20.23 7.61 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.62 1.568 . . . . 0.60999999999999999 111.481 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.61 -45.84 76.31 Favored Glycine 0 CA--C 1.528 0.871 0 N-CA-C 110.998 -0.841 . . . . 0.45000000000000001 110.998 -173.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.77 -28.79 61.83 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.818 2.847 . . . . 4.1100000000000003 115.34 172.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.7 mm-40 -71.92 -33.94 68.68 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 118.767 0.712 . . . . 0.72999999999999998 111.433 169.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -68.49 -40.92 80.73 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 121.806 -0.559 . . . . 1.6599999999999999 111.226 171.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.632 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 32.9 mmtp -51.94 -52.64 48.8 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.824 0.821 . . . . 0.80000000000000004 111.0 170.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 46.4 t -59.48 -53.07 62.36 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 126.216 1.807 . . . . 0.67000000000000004 112.772 179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.23 -52.49 58.53 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.55 1.14 . . . . 0.37 112.794 -178.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.91 -26.87 54.62 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 113.659 0.985 . . . . 2.2999999999999998 113.659 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.4 p -70.86 -45.09 65.06 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 120.212 1.369 . . . . 1.3799999999999999 112.653 167.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 31.6 t -54.0 -45.73 71.56 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 118.85 0.75 . . . . 0.51000000000000001 110.833 173.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -60.95 -47.68 85.32 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.121 0.969 . . . . 2.3999999999999999 113.114 172.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 t-80 -57.42 -36.66 71.63 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.098 0.863 . . . . 4.8799999999999999 112.36 -178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.37 -13.83 48.25 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 114.403 1.26 . . . . 2.6099999999999999 114.403 174.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.1 t -71.96 -60.88 2.0 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 120.018 1.281 . . . . 0.95999999999999996 112.983 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.266 70.5 p 49.8 55.19 9.79 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.956 1.703 . . . . 1.5700000000000001 114.395 -172.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -80.5 -85.34 0.09 Allowed 'General case' 0 CA--C 1.546 0.801 0 O-C-N 121.103 -0.998 . . . . 2.54 111.779 163.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -167.21 -48.41 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.919 1.687 . . . . 4.4400000000000004 111.713 -175.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.0 mt -87.61 157.2 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.46 1.904 . . . . 1.5700000000000001 109.085 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 37.4 mmtm -68.18 93.64 0.46 Allowed 'General case' 0 N--CA 1.467 0.403 0 O-C-N 121.066 -1.021 . . . . 2.29 111.306 170.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.7 42.26 10.15 Favored Glycine 0 CA--C 1.528 0.863 0 CA-C-O 118.881 -0.955 . . . . 0.91000000000000003 115.28 173.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.7 t -57.81 -37.88 74.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 119.814 1.807 . . . . 1.95 111.369 164.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -85.36 -2.25 57.89 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.945 1.298 . . . . 2.6299999999999999 113.876 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.5 m -141.65 12.67 2.1 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.913 1.449 . . . . 0.57999999999999996 114.913 -162.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.45 -28.36 30.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 C-N-CA 124.847 1.259 . . . . 1.8600000000000001 113.081 -170.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -64.65 -26.55 68.43 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 119.737 1.153 . . . . 2.48 113.165 177.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -75.77 -38.83 57.98 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.829 -1.169 . . . . 0.73999999999999999 112.235 172.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -65.85 -36.76 84.36 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 120.616 -1.302 . . . . 1.6799999999999999 110.563 171.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 60.5 ttp85 -60.13 -41.98 93.82 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 118.269 -0.872 . . . . 4.4900000000000002 111.517 169.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.77 -35.3 79.37 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 113.37 0.878 . . . . 0.66000000000000003 113.37 172.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.57 -50.81 71.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 118.976 0.807 . . . . 4.2300000000000004 110.762 169.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.1 mm100 -61.71 -49.78 75.08 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-N 119.207 0.912 . . . . 3.96 113.182 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -62.21 -18.6 61.55 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 129.329 3.051 . . . . 2.4700000000000002 114.245 177.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 48.8 t -91.83 -40.01 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.264 1.025 . . . . 0.90000000000000002 113.05 164.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 38.1 mtm -73.17 -21.16 60.75 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 119.804 -1.81 . . . . 4.0499999999999998 111.304 -169.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -56.49 -18.83 12.75 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.312 1.445 . . . . 2.25 113.733 165.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.2 mmmm -62.78 -34.83 78.06 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 125.759 1.623 . . . . 3.5600000000000001 113.86 173.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -144.29 127.82 8.84 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.189 0.996 . . . . 2.8799999999999999 111.238 -167.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -81.24 -45.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 121.552 1.501 . . . . 2.5899999999999999 115.245 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 49.1 t0 -160.16 64.99 0.34 Allowed 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 122.992 1.377 . . . . 4.3300000000000001 110.848 -161.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.282 0.4 OUTLIER -135.9 -14.01 1.87 Allowed 'General case' 0 CA--C 1.561 1.369 0 CA-C-N 113.017 -1.901 . . . . 2.0800000000000001 112.012 -160.153 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.457 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 2.5 p90 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 126.033 1.733 . . . . 3.4300000000000002 115.235 -162.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' B' ' 62' ' ' HIS . 0.7 OUTLIER . . . . . 0 N--CA 1.481 1.108 0 N-CA-C 111.236 0.087 . . . . 17.5 111.236 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . 0.41 ' H ' ' CD ' ' B' ' 61' ' ' GLU . 79.5 m80 -83.5 -178.89 7.2 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.16 2.184 . . . . 13.279999999999999 113.277 -177.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 71.8 m -58.59 155.14 12.92 Favored 'General case' 0 CA--C 1.543 0.696 0 O-C-N 120.949 -1.094 . . . . 7.5 111.853 165.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.44 -50.6 4.08 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 124.507 1.051 . . . . 3.1299999999999999 111.189 -165.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 34.6 m80 -82.44 -40.66 20.87 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.537 0.94 . . . . 5.5300000000000002 113.537 176.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.3 pp -59.43 -30.09 68.23 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 117.379 -1.296 . . . . 2.75 113.856 -176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 14.0 tt -71.46 -30.34 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 CA-C-N 120.63 1.559 . . . . 2.0499999999999998 113.573 173.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.02 -29.16 66.14 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.104 -0.997 . . . . 4.0800000000000001 110.741 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -75.68 -33.13 60.36 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.135 -0.978 . . . . 1.25 113.24 168.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 -56.6 -52.78 63.54 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.537 1.062 . . . . 1.5700000000000001 109.292 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -66.13 -44.91 82.86 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 124.269 1.027 . . . . 5.1900000000000004 112.142 -178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.06 -42.6 85.8 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 119.331 0.969 . . . . 4.6600000000000001 111.971 175.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.0 m -68.8 -45.48 71.16 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.226 0.61 . . . . 1.46 112.524 -179.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 21.1 ptp -70.58 -31.49 68.52 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 121.558 -0.714 . . . . 3.8799999999999999 112.668 177.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -68.19 -38.87 82.47 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.062 0.945 . . . . 5.4900000000000002 111.839 171.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.17 -39.83 91.59 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 118.745 0.702 . . . . 1.04 111.459 171.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 1.3 tt -62.09 -48.91 78.06 Favored 'General case' 0 CA--C 1.55 0.979 0 O-C-N 121.724 -0.61 . . . . 4.0700000000000003 111.537 171.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.66 -30.99 69.99 Favored Glycine 0 CA--C 1.537 1.469 0 O-C-N 120.978 -1.077 . . . . 2.5 114.252 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 44.6 t80 -74.86 -34.23 62.24 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.967 2.107 . . . . 4.1600000000000001 113.188 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtt -68.5 -38.36 80.89 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 117.75 -1.119 . . . . 3.6800000000000002 112.799 174.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 44.9 pt . . . . . 0 N--CA 1.489 1.499 0 C-N-CA 124.493 1.117 . . . . 5.6299999999999999 113.925 179.057 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 7.5 p30 . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 113.975 1.102 . . . . 5.54 113.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.5 -32.65 6.96 Favored Glycine 0 CA--C 1.533 1.181 0 C-N-CA 124.806 1.193 . . . . 3.2599999999999998 113.142 -178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 59.09 -3.9 0.08 Allowed 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 120.387 3.477 . . . . 3.6699999999999999 120.387 153.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.44 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.3 mp 68.38 -54.46 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 127.373 2.269 . . . . 2.54 115.268 176.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 69.86 94.78 0.07 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 127.448 2.299 . . . . 2.21 113.124 -163.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 40.3 m95 -82.28 28.86 0.44 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.72 2.408 . . . . 1.23 114.352 -166.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -103.35 165.98 10.71 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.949 2.1 . . . . 3.5 110.817 -176.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.426 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 32.5 t 68.77 147.08 0.11 Allowed Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.63 2.772 . . . . 5.1600000000000001 113.337 -166.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 43.2 Cg_exo -68.55 19.15 0.14 Allowed 'Trans proline' 0 C--N 1.357 1.01 0 C-N-CA 124.031 3.154 . . . . 5.29 117.075 -171.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 m -101.84 -101.17 0.27 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.026 1.331 . . . . 3.1499999999999999 109.773 -170.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 tt -57.85 -40.8 81.01 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 121.147 -0.971 . . . . 2.1099999999999999 109.552 166.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -62.05 -26.73 67.79 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 121.259 -0.9 . . . . 1.9099999999999999 115.036 173.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.72 -40.76 65.16 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.579 1.085 . . . . 1.78 113.127 171.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 83.8 mmm -70.41 -40.34 73.94 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.801 1.24 . . . . 2.3199999999999998 112.189 173.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.16 -9.02 58.28 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.109 1.152 . . . . 0.96999999999999997 114.109 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 m -95.23 127.93 41.67 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.251 1.42 . . . . 2.23 110.548 168.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 154.99 175.19 25.78 Favored Glycine 0 CA--C 1.54 1.621 0 N-CA-C 115.693 1.037 . . . . 1.3899999999999999 115.693 175.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.92 -35.36 59.87 Favored 'Trans proline' 0 C--N 1.347 0.484 1 C-N-CA 126.074 4.516 . . . . 1.6100000000000001 114.464 170.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -113.34 16.75 18.9 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.689 1.996 . . . . 0.76000000000000001 111.955 175.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.64 -38.09 86.19 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 123.536 0.589 . . . . 0.91000000000000003 111.672 -175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -60.8 -27.99 68.44 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.493 1.517 . . . . 3.1400000000000001 113.74 175.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -70.77 -33.63 70.97 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.694 -0.629 . . . . 0.90000000000000002 110.472 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -65.32 -42.35 93.05 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 118.466 0.575 . . . . 2.3399999999999999 111.178 167.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.3 mmtp -56.07 -51.04 69.25 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.424 0.689 . . . . 0.92000000000000004 110.285 175.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -61.71 -44.5 96.8 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.245 1.818 . . . . 0.52000000000000002 112.642 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.44 -52.09 43.71 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.097 -1.002 . . . . 0.38 113.257 178.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -30.87 62.93 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 118.376 -0.821 . . . . 2.0699999999999998 112.928 -176.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -67.75 -46.03 73.25 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.848 1.204 . . . . 1.3899999999999999 112.214 168.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.9 t -57.32 -39.99 76.98 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.148 1.34 . . . . 0.56000000000000005 111.62 173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -61.97 -45.77 92.19 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.194 -0.941 . . . . 2.0600000000000001 113.112 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -61.76 -32.23 72.47 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.261 0.937 . . . . 4.9299999999999997 111.897 175.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 3.6 m-30 -77.54 -17.39 57.96 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 124.984 1.313 . . . . 3.3700000000000001 111.996 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -91.57 -64.32 1.14 Allowed 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 126.39 1.876 . . . . 0.97999999999999998 112.54 -178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 66.2 p 50.0 32.18 5.46 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 125.681 1.592 . . . . 1.55 115.044 -174.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -71.07 -70.82 0.29 Allowed 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.662 -1.274 . . . . 3.48 114.096 -175.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 83.3 tt0 -162.73 -43.6 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.787 1.235 . . . . 3.2400000000000002 112.559 -163.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 6.0 mt -134.68 157.81 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.447 1.899 . . . . 2.0899999999999999 109.75 -169.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.2 mmtm -64.3 93.0 0.09 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.001 -1.062 . . . . 1.8700000000000001 110.439 168.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 94.74 19.78 30.81 Favored Glycine 0 CA--C 1.533 1.196 0 CA-C-O 118.031 -1.427 . . . . 1.3500000000000001 116.568 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.7 p -60.51 -20.72 61.08 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.642 2.221 . . . . 1.55 113.756 170.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -119.95 8.18 11.02 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.604 1.161 . . . . 2.0699999999999998 114.039 171.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -148.34 12.45 0.93 Allowed 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.871 1.434 . . . . 0.52000000000000002 114.871 -164.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -54.63 -31.89 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-O 117.801 -1.095 . . . . 1.71 112.999 -176.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -57.86 -24.94 59.87 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.541 1.519 . . . . 2.0699999999999998 113.486 -178.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -82.06 -42.16 19.61 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.024 1.33 . . . . 0.56999999999999995 112.771 176.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -62.35 -43.64 98.36 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 120.764 -1.21 . . . . 1.76 110.597 171.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 4.5 tpm_? -55.73 -45.1 78.05 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 126.099 1.759 . . . . 7.4400000000000004 110.885 169.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.18 -34.72 76.96 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 119.379 0.99 . . . . 0.64000000000000001 112.701 175.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.5 ttt -61.79 -47.6 84.4 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.401 1.001 . . . . 4.0800000000000001 111.911 172.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 99.0 mt-30 -59.3 -48.31 82.09 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.282 0.563 . . . . 4.0700000000000003 112.074 175.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -61.47 -24.72 66.76 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 128.244 2.618 . . . . 2.3300000000000001 114.331 175.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.4 t -83.2 -39.57 20.79 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 124.661 1.185 . . . . 0.88 111.201 171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.2 mtp -83.72 -19.82 34.54 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 121.046 -1.034 . . . . 3.9199999999999999 111.403 -170.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -69.19 -5.22 21.22 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.18 1.392 . . . . 2.48 113.729 167.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -79.16 -29.89 43.25 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 114.278 1.214 . . . . 3.9199999999999999 114.278 171.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.404 ' CB ' HD12 ' A' ' 59' ' ' LEU . 6.3 m-85 -121.66 130.6 24.7 Favored Pre-proline 0 N--CA 1.47 0.544 0 CA-C-N 118.794 0.725 . . . . 3.02 112.838 -165.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -89.1 -28.04 0.34 Allowed 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.942 2.428 . . . . 4.7599999999999998 113.564 171.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -161.69 -0.8 0.05 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.824 1.416 . . . . 7.7699999999999996 114.824 -156.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD13 ' N ' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -70.28 -17.72 63.1 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.668 1.987 . . . . 3.9700000000000002 112.975 -165.182 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.428 ' N ' HD13 ' A' ' 59' ' ' LEU . 43.2 m-85 . . . . . 0 C--O 1.252 1.226 0 C-N-CA 128.893 2.877 . . . . 4.9500000000000002 113.382 -167.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 119.91 -0.09 . . . . 11.119999999999999 110.872 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -110.66 148.19 32.75 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.654 1.182 . . . . 8.8399999999999999 112.288 172.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -11.86 0.59 Allowed 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.119 1.367 . . . . 4.5499999999999998 114.137 172.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.3 174.1 50.15 Favored Glycine 0 CA--C 1.534 1.265 0 O-C-N 121.224 -0.923 . . . . 3.96 115.066 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -66.01 -37.96 87.24 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.152 1.381 . . . . 7.0700000000000003 113.49 -170.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -54.21 -42.86 70.25 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.001 1.112 . . . . 2.54 114.001 -168.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.61 -43.51 93.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 120.743 1.61 . . . . 2.6499999999999999 112.796 -176.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -73.28 -21.31 60.62 Favored 'General case' 0 CA--C 1.546 0.798 0 O-C-N 120.953 -1.092 . . . . 4.2000000000000002 111.704 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -78.36 -30.28 47.9 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 125.189 1.396 . . . . 1.3899999999999999 113.325 169.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -63.49 -48.03 79.33 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 120.649 -1.282 . . . . 1.8899999999999999 109.208 167.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -59.67 -43.14 94.08 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.745 0.818 . . . . 3.9900000000000002 112.559 175.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.7 -45.07 86.2 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.57 1.148 . . . . 5.54 111.715 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 27.7 m -67.68 -46.91 70.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.637 0.775 . . . . 1.75 112.447 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.5 ptm -70.45 -31.1 68.12 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 121.273 -0.892 . . . . 2.5800000000000001 112.343 178.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 32.4 ttp-105 -64.68 -40.49 95.49 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.47 1.032 . . . . 7.7199999999999998 111.927 169.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.98 -41.53 98.12 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.529 0.604 . . . . 1.2 111.957 172.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.3 mp -64.59 -30.9 71.93 Favored 'General case' 0 N--CA 1.476 0.859 0 O-C-N 121.008 -1.057 . . . . 2.8700000000000001 112.756 169.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.14 -43.26 98.53 Favored Glycine 0 CA--C 1.534 1.232 0 C-N-CA 125.598 1.57 . . . . 2.5600000000000001 113.078 170.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -72.61 -42.29 64.64 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.527 -0.984 . . . . 5.2000000000000002 113.429 171.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 76.2 tttt -70.3 -40.41 74.27 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.98 1.312 . . . . 4.5 113.751 -173.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 31.2 mm . . . . . 0 N--CA 1.482 1.133 0 CA-C-O 116.92 -1.514 . . . . 4.0800000000000001 112.677 -168.312 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 55.0 t30 . . . . . 0 N--CA 1.477 0.918 0 CA-C-O 118.594 -0.717 . . . . 5.6500000000000004 112.76 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.8 21.85 78.85 Favored Glycine 0 CA--C 1.539 1.55 0 CA-C-N 121.02 1.736 . . . . 3.1299999999999999 113.793 -173.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -109.86 -34.02 6.56 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 126.394 1.878 . . . . 4.9000000000000004 112.726 -171.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp 61.3 -55.7 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 127.575 2.35 . . . . 2.23 114.073 -167.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.2 97.06 0.06 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 127.095 2.158 . . . . 2.4300000000000002 112.915 -163.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.499 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 43.1 m95 -77.46 3.74 12.69 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.565 1.946 . . . . 1.25 113.982 -168.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -65.92 -30.42 71.0 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.944 2.098 . . . . 2.7200000000000002 113.549 176.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.7 t -63.91 128.69 93.23 Favored Pre-proline 0 N--CA 1.473 0.706 0 C-N-CA 124.685 1.194 . . . . 4.8700000000000001 110.885 -177.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -74.83 -18.82 18.87 Favored 'Trans proline' 0 CA--C 1.536 0.611 0 C-N-CA 122.515 2.143 . . . . 4.4000000000000004 116.433 -152.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -94.37 -51.78 4.64 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.666 1.121 . . . . 4.5199999999999996 111.487 178.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.6 tt -60.71 -41.48 95.34 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.271 -0.893 . . . . 1.75 110.397 171.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.18 -25.22 62.02 Favored Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.792 1.187 . . . . 1.26 114.378 174.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.09 -45.77 54.59 Favored Glycine 0 CA--C 1.531 1.032 0 CA-C-N 118.883 1.342 . . . . 1.28 110.916 170.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.9 tpt -58.08 -37.4 74.39 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.182 1.393 . . . . 2.0099999999999998 112.777 171.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.99 9.82 9.32 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 114.903 1.446 . . . . 0.68999999999999995 114.903 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 57.4 m -115.08 165.38 12.96 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.366 1.466 . . . . 1.1499999999999999 113.913 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.39 -178.53 34.23 Favored Glycine 0 CA--C 1.542 1.737 0 C-N-CA 126.582 2.039 . . . . 0.68000000000000005 114.258 -179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -41.42 -42.69 5.62 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 124.921 3.747 . . . . 1.03 114.933 167.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 45.7 m -99.59 13.02 34.94 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.542 1.137 . . . . 0.59999999999999998 112.923 -173.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.41 -41.47 93.24 Favored Glycine 0 C--N 1.34 0.795 0 N-CA-C 110.882 -0.887 . . . . 0.48999999999999999 110.882 -174.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -61.27 -27.29 68.36 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.224 1.81 . . . . 2.6600000000000001 113.453 176.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -70.19 -35.32 73.86 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.576 0.625 . . . . 0.77000000000000002 110.128 171.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -69.56 -44.73 70.3 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 118.659 0.663 . . . . 1.6100000000000001 112.678 169.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -51.11 -49.61 60.42 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 118.56 0.618 . . . . 0.62 110.005 175.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 24.3 t -67.12 -45.49 77.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.767 2.027 . . . . 0.48999999999999999 113.246 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.49 -53.4 35.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.29 1.036 . . . . 0.31 112.857 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -70.85 -33.32 70.53 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 118.041 -0.98 . . . . 2.0499999999999998 112.354 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 48.5 t -60.99 -53.5 56.44 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.134 1.334 . . . . 1.75 110.738 168.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.7 t -54.76 -44.32 73.54 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.138 0.881 . . . . 0.51000000000000001 111.125 -178.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -59.94 -47.56 85.3 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.728 1.211 . . . . 2.3300000000000001 113.015 172.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -68.53 -27.2 65.89 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 120.081 1.309 . . . . 2.8799999999999999 113.927 -178.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -76.85 -17.17 59.15 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 121.07 -1.019 . . . . 2.6800000000000002 113.396 165.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.2 t -92.58 -60.12 1.9 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.961 1.304 . . . . 0.81999999999999995 113.267 -177.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.6 p 43.51 42.61 4.07 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 126.485 1.914 . . . . 1.1699999999999999 114.036 -174.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -60.06 2.43 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.882 1.273 . . . . 2.9300000000000002 113.174 -170.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -168.79 -47.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.523 1.529 . . . . 2.8500000000000001 111.744 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 30.6 mt -117.75 151.56 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 126.864 2.066 . . . . 1.5700000000000001 108.572 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -49.84 106.34 0.11 Allowed 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 118.778 0.717 . . . . 1.6399999999999999 111.47 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.81 26.92 69.28 Favored Glycine 0 CA--C 1.534 1.275 0 CA-C-O 117.199 -1.89 . . . . 0.89000000000000001 116.411 176.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.1 p -49.11 -32.92 10.74 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 121.052 2.426 . . . . 1.29 114.332 175.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 41.1 t0 -109.38 35.76 3.18 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.175 1.79 . . . . 2.7000000000000002 112.473 173.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.3 m -157.08 10.18 0.21 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.109 2.164 . . . . 0.53000000000000003 114.01 -174.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -60.88 -27.94 42.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 CA-C-N 120.165 1.348 . . . . 1.8400000000000001 113.666 -162.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -53.27 -28.53 28.24 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.436 1.494 . . . . 2.1400000000000001 114.085 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -74.79 -44.21 50.66 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.937 1.295 . . . . 0.75 112.973 174.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -68.12 -37.75 81.47 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.195 -0.941 . . . . 2.0899999999999999 110.026 175.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.7 ttp180 -59.89 -42.54 94.03 Favored 'General case' 0 N--CA 1.462 0.148 0 C-N-CA 125.743 1.617 . . . . 4.9299999999999997 111.97 170.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.86 -38.61 91.51 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.224 0.824 . . . . 0.62 113.224 169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.1 ttt -59.55 -44.03 93.36 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.982 0.81 . . . . 3.3300000000000001 111.678 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -69.09 -41.47 77.43 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 113.026 0.75 . . . . 4.0700000000000003 113.026 175.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -60.67 -21.79 63.19 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.779 2.032 . . . . 2.4100000000000001 114.247 170.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 31.8 t -90.29 -39.4 12.76 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.213 1.805 . . . . 0.71999999999999997 112.144 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 37.3 mtt -88.22 -15.78 35.0 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 120.697 -1.252 . . . . 2.3300000000000001 111.781 -170.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -60.13 -20.98 60.94 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.758 1.223 . . . . 1.5700000000000001 112.459 165.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 20.0 mtmt -76.12 -33.43 59.44 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.525 1.13 . . . . 2.8900000000000001 113.283 168.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 16.2 m-85 -135.1 108.62 10.51 Favored Pre-proline 0 CA--C 1.544 0.741 0 N-CA-C 113.794 1.035 . . . . 2.4100000000000001 113.794 -161.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -79.56 -50.98 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 122.686 2.257 . . . . 2.3199999999999998 113.609 -173.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -159.62 62.55 0.37 Allowed 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 124.293 1.996 . . . . 4.7699999999999996 110.659 -178.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.474 ' O ' HD22 ' A' ' 59' ' ' LEU 0.27 0.4 OUTLIER -106.34 -9.14 16.9 Favored 'General case' 0 CA--C 1.549 0.905 0 CA-C-N 112.622 -2.081 . . . . 1.8999999999999999 111.719 -157.982 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 17.7 p90 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 128.141 2.576 . . . . 2.7999999999999998 111.984 -165.252 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.482 1.172 0 N-CA-C 109.323 -0.621 . . . . 14.23 109.323 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 59.56 25.7 14.6 Favored 'General case' 0 CA--C 1.553 1.063 0 N-CA-C 115.569 1.692 . . . . 10.75 115.569 175.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.0 t -98.98 144.83 27.69 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.095 1.358 . . . . 4.9800000000000004 110.576 167.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -58.25 134.42 52.41 Favored Glycine 0 CA--C 1.536 1.355 0 N-CA-C 115.247 0.859 . . . . 2.9100000000000001 115.247 -164.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -58.76 -15.71 13.42 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.085 1.354 . . . . 7.2800000000000002 114.171 175.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -59.66 -29.24 67.91 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 117.331 -1.319 . . . . 3.1699999999999999 113.685 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 12.7 tt -64.48 -37.89 81.18 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.389 0 CA-C-N 122.327 2.331 . . . . 2.2599999999999998 112.62 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -69.67 -32.35 70.93 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.343 -0.848 . . . . 4.9900000000000002 110.902 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.6 -36.16 73.38 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.27 1.028 . . . . 1.27 113.162 171.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 -62.31 -46.22 89.71 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.28 0.945 . . . . 1.26 109.544 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -63.67 -46.61 84.77 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.497 0.555 . . . . 3.9100000000000001 112.497 174.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -64.12 -41.7 97.13 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.627 0.771 . . . . 3.6800000000000002 112.612 -179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 79.5 p -74.0 -40.14 63.15 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.937 0.895 . . . . 2.1499999999999999 112.875 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 24.3 ptm -67.07 -35.41 79.78 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.257 1.39 . . . . 2.8700000000000001 111.691 173.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.37 92.81 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 121.299 -0.876 . . . . 5.6799999999999997 110.919 171.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.74 -45.61 91.67 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.229 0.611 . . . . 1.22 111.942 176.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.11 -50.64 72.8 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 123.552 0.741 . . . . 3.48 111.161 173.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -61.38 -28.68 69.81 Favored Glycine 0 CA--C 1.536 1.384 0 CA-C-N 118.934 0.788 . . . . 1.99 114.202 178.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -79.65 -25.7 41.29 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.122 1.369 . . . . 4.1399999999999997 113.476 170.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 58.1 tttm -85.9 -59.12 2.39 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.748 1.619 . . . . 3.8399999999999999 113.788 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 9.1 pt . . . . . 0 N--CA 1.483 1.187 0 N-CA-C 114.6 1.333 . . . . 5.29 114.6 -160.83 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 118.456 -0.783 . . . . 6.2599999999999998 110.993 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.66 6.45 66.71 Favored Glycine 0 CA--C 1.541 1.711 0 N-CA-C 116.553 1.381 . . . . 4.1399999999999997 116.553 -178.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -85.47 -179.95 7.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.844 1.658 . . . . 3.7200000000000002 113.576 -172.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.418 HG21 HD22 ' A' ' 11' ' ' LEU . 2.6 mp -51.87 145.04 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 124.278 1.031 . . . . 2.9900000000000002 110.213 156.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -79.66 111.76 16.27 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.371 -0.831 . . . . 2.3599999999999999 109.838 156.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.543 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 65.1 m95 -86.84 10.3 16.48 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 120.827 -1.171 . . . . 1.3100000000000001 113.912 -172.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -130.5 -40.92 1.23 Allowed 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 115.571 1.693 . . . . 2.2400000000000002 115.571 -168.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.9 m -81.19 -45.93 1.15 Allowed Pre-proline 0 CA--C 1.543 0.678 0 CA-C-N 119.916 1.235 . . . . 5.2599999999999998 114.265 177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -81.38 173.61 11.42 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.724 2.282 . . . . 7.5099999999999998 112.631 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.7 t -77.09 19.04 0.33 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 115.984 1.846 . . . . 3.9199999999999999 115.984 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.418 HD22 HG21 ' A' ' 4' ' ' ILE . 2.8 mp -78.42 -6.63 55.84 Favored 'General case' 0 CA--C 1.548 0.879 0 O-C-N 120.892 -1.13 . . . . 1.4299999999999999 111.286 157.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -47.5 -60.23 5.41 Favored Glycine 0 CA--C 1.532 1.113 0 C-N-CA 126.152 1.834 . . . . 1.23 115.697 -172.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.13 -35.93 56.89 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 117.485 0.643 . . . . 1.29 112.65 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.8 tpt -56.28 -45.06 80.3 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.903 1.281 . . . . 1.9099999999999999 112.713 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.598 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -85.58 0.91 51.17 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 125.925 1.69 . . . . 0.72999999999999998 114.073 -175.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.9 m -98.24 -176.41 3.4 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.563 1.945 . . . . 1.1499999999999999 111.567 171.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.47 177.8 49.55 Favored Glycine 0 CA--C 1.542 1.719 0 O-C-N 121.006 -1.059 . . . . 0.69999999999999996 114.532 -179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -45.78 -40.93 19.75 Favored 'Trans proline' 0 C--N 1.349 0.578 1 C-N-CA 126.208 4.605 . . . . 1.0900000000000001 114.518 174.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.6 m -112.55 18.75 18.14 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.535 1.534 . . . . 0.56999999999999995 112.347 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.84 -38.74 89.8 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 111.073 -0.811 . . . . 0.47999999999999998 111.073 -173.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -58.25 -31.23 67.22 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.728 1.611 . . . . 2.98 113.66 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -71.61 -32.13 67.66 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.434 0.561 . . . . 0.73999999999999999 109.792 175.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -67.61 -41.78 83.46 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-O 119.078 -0.487 . . . . 1.6499999999999999 112.059 167.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.598 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 34.6 mmtp -56.81 -52.96 63.03 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.288 0.635 . . . . 0.62 110.294 176.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.1 t -65.88 -44.67 84.65 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.118 1.767 . . . . 0.52000000000000002 112.894 -179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.8 -56.35 9.51 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.013 -1.055 . . . . 0.37 112.633 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -71.36 -29.34 64.86 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.019 -0.991 . . . . 2.8700000000000001 112.593 -176.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 8.1 t -74.58 -41.88 59.71 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 120.411 1.459 . . . . 1.9399999999999999 112.796 170.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.5 t -55.8 -42.35 75.47 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 120.981 1.719 . . . . 0.41999999999999998 110.602 172.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.84 -46.4 90.72 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.566 1.146 . . . . 2.3799999999999999 113.299 169.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 66.6 t-80 -62.71 -37.5 86.76 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.767 1.167 . . . . 4.0099999999999998 112.995 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -79.33 -16.76 55.8 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.026 0.53 . . . . 2.4500000000000002 111.942 172.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 31.9 t -81.43 -66.39 0.89 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.93 1.292 . . . . 0.81999999999999995 113.536 176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.27 67.8 p 47.71 43.4 16.7 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 127.352 2.261 . . . . 1.1699999999999999 114.546 -172.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.06 -52.05 21.68 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.79 1.404 . . . . 3.25 114.79 -171.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.2 tt0 -174.18 -43.79 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 126.043 1.737 . . . . 2.73 110.971 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.1 mt -134.69 147.27 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 C-N-CA 128.231 2.613 . . . . 1.71 108.696 -169.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 31.8 mmtm -44.68 109.97 0.2 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 124.768 1.227 . . . . 1.6799999999999999 111.42 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.76 20.56 70.43 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-O 117.925 -1.486 . . . . 0.90000000000000002 116.278 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.7 t -50.98 -31.54 18.26 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 119.999 1.9 . . . . 1.8100000000000001 113.679 173.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -94.03 6.05 49.76 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 115.034 1.494 . . . . 2.1499999999999999 115.034 173.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 95.5 m -145.29 17.58 1.54 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 120.83 -1.169 . . . . 0.44 112.84 -156.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.2 m -61.17 -26.37 39.02 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.929 0.715 . . . . 1.96 112.929 -164.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -65.95 -26.6 67.65 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.47 1.032 . . . . 2.3599999999999999 113.001 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.18 -37.65 66.43 Favored 'General case' 0 CA--C 1.547 0.839 0 O-C-N 121.245 -0.909 . . . . 0.81000000000000005 111.055 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -70.85 -35.87 72.6 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 120.784 -1.198 . . . . 1.73 111.106 171.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 51.1 ttp85 -55.92 -44.34 78.2 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.295 1.038 . . . . 4.5599999999999996 111.59 170.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.16 -37.2 83.35 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 113.062 0.764 . . . . 0.56999999999999995 113.062 173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.5 ttm -54.54 -47.39 73.25 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.571 -0.706 . . . . 2.8199999999999998 111.368 172.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -62.34 -54.41 40.86 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 118.11 0.414 . . . . 3.7599999999999998 111.988 174.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -56.75 -22.88 38.87 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 127.181 2.193 . . . . 2.3999999999999999 115.479 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.0 t -90.91 -46.62 8.07 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.62 1.168 . . . . 0.68000000000000005 112.077 171.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.4 mtt -76.62 -19.67 57.56 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.854 -1.154 . . . . 2.0899999999999999 111.398 -167.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -55.58 -26.8 45.61 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 125.692 1.597 . . . . 1.6899999999999999 113.328 170.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -61.0 -32.39 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 115.14 1.533 . . . . 3.8399999999999999 115.14 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -144.32 126.6 8.32 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.727 1.01 . . . . 2.2400000000000002 113.727 -161.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -94.37 -38.98 0.03 OUTLIER 'Trans proline' 0 CA--C 1.536 0.595 0 C-N-CA 122.674 2.25 . . . . 2.3700000000000001 115.46 177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -152.98 76.73 1.14 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 123.169 1.461 . . . . 4.46 109.913 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.261 0.2 OUTLIER -144.84 -8.4 0.63 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 113.463 -1.699 . . . . 2.0099999999999998 111.132 -163.219 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.358 0 C-N-CA 127.775 2.43 . . . . 2.5 113.584 -164.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.092 -0.336 . . . . 13.6 110.092 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.8 p80 -145.13 173.05 12.25 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.793 0.837 . . . . 8.5600000000000005 111.848 166.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 128.93 38.2 Favored 'General case' 0 CA--C 1.543 0.685 0 O-C-N 121.777 -0.577 . . . . 4.4000000000000004 109.584 175.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -69.63 173.39 37.47 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.562 1.077 . . . . 3.1899999999999999 115.384 -170.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 35.4 m-70 -78.52 -5.9 53.95 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.263 1.425 . . . . 6.04 113.824 -173.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.51 HD23 ' H ' ' B' ' 66' ' ' LEU . 1.8 pt? -63.81 -34.75 78.61 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.337 1.055 . . . . 2.7999999999999998 113.746 175.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -37.78 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 120.515 1.507 . . . . 2.3199999999999998 113.468 -172.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -60.61 -41.53 94.97 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.524 -0.735 . . . . 3.9300000000000002 110.276 175.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.55 -33.78 71.51 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.029 1.332 . . . . 1.29 113.177 175.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 m-70 -57.73 -49.29 77.03 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.523 1.056 . . . . 1.4299999999999999 109.974 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -65.54 -45.98 81.33 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.835 0.854 . . . . 5.8099999999999996 111.648 -178.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -57.96 -44.45 87.06 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 118.333 0.515 . . . . 4.2800000000000002 111.996 173.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 43.2 t -65.17 -45.91 82.95 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 118.646 0.657 . . . . 1.9399999999999999 111.973 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 28.6 ptm -68.21 -31.69 71.38 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.928 1.24 . . . . 2.6200000000000001 113.101 177.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.3 tmt_? -67.15 -48.13 68.96 Favored 'General case' 0 N--CA 1.476 0.851 0 O-C-N 121.686 -0.634 . . . . 6.1299999999999999 111.018 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -66.64 -39.93 88.47 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.719 1.207 . . . . 0.98999999999999999 112.541 178.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.8 tt -61.88 -43.26 99.21 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.419 -0.801 . . . . 3.0299999999999998 110.548 171.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.98 -43.83 92.96 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.546 0.612 . . . . 1.8700000000000001 113.563 172.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -67.99 -31.89 71.92 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 125.876 1.671 . . . . 4.0800000000000001 113.845 175.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -80.71 -49.38 11.26 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.494 1.518 . . . . 3.3700000000000001 113.327 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.7 mm . . . . . 0 C--O 1.253 1.288 0 C-N-CA 125.333 1.453 . . . . 4.9400000000000004 113.381 -165.818 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.996 -0.526 . . . . 4.8600000000000003 111.491 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.18 15.99 32.15 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.051 1.31 . . . . 2.6400000000000001 115.681 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 -82.41 164.4 21.03 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 119.174 1.487 . . . . 3.7200000000000002 114.773 -165.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.7 mp -59.57 152.43 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 126.871 2.068 . . . . 2.75 109.908 161.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -96.34 106.57 18.82 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.475 -0.765 . . . . 2.3799999999999999 109.997 158.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.54 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 68.5 m95 -77.14 -62.82 1.53 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.126 0.97 . . . . 2.0099999999999998 111.785 -167.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 53.1 -138.86 1.08 Allowed 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 126.318 1.847 . . . . 3.8500000000000001 114.275 170.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.2 t -99.3 -58.78 0.13 Allowed Pre-proline 0 N--CA 1.477 0.904 0 C-N-CA 126.679 1.992 . . . . 7.4100000000000001 113.928 -176.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -79.8 -179.83 5.65 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 122.92 2.413 . . . . 4.3300000000000001 111.857 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.5 m 58.25 -108.58 0.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.255 1.422 . . . . 3.6899999999999999 112.069 175.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 mp -75.95 -11.88 60.04 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.382 0.992 . . . . 1.28 113.605 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.75 -43.43 86.77 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 116.034 1.174 . . . . 1.25 116.034 -162.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.16 -39.58 31.65 Favored Glycine 0 CA--C 1.533 1.184 0 C-N-CA 124.409 1.004 . . . . 1.5900000000000001 113.054 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 8.0 tpt -60.77 -37.81 83.12 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.542 1.137 . . . . 2.1400000000000001 112.625 176.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.472 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.85 -1.94 57.12 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.717 1.607 . . . . 0.75 113.783 179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.2 m -97.69 163.13 12.95 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.824 1.65 . . . . 1.1299999999999999 111.476 173.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.08 178.71 38.85 Favored Glycine 0 CA--C 1.542 1.742 0 N-CA-C 115.951 1.141 . . . . 1.0600000000000001 115.951 173.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -42.23 -30.23 1.34 Allowed 'Trans proline' 0 CA--C 1.539 0.746 1 C-N-CA 126.916 5.077 . . . . 1.3700000000000001 117.737 174.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 m -114.55 8.86 16.5 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.13 1.372 . . . . 0.56000000000000005 113.749 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.16 -52.19 10.55 Favored Glycine 0 C--N 1.337 0.621 0 C-N-CA 125.654 1.597 . . . . 0.47999999999999998 113.191 178.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -63.63 -24.29 67.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 117.636 -1.173 . . . . 4.75 113.939 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 31.2 mm-40 -66.98 -35.87 80.92 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 120.204 1.366 . . . . 0.84999999999999998 109.621 171.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -68.63 -44.08 74.99 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.027 0.751 . . . . 1.6000000000000001 113.027 171.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.6 mmtp -57.17 -52.07 66.78 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 118.642 0.656 . . . . 0.62 110.795 177.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 27.3 t -70.39 -41.54 72.88 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.978 1.711 . . . . 0.75 112.003 -176.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.86 -55.36 19.94 Favored 'General case' 0 N--CA 1.467 0.381 0 O-C-N 120.499 -1.376 . . . . 0.34000000000000002 112.805 173.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.59 -33.38 68.98 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.679 -0.677 . . . . 1.97 112.345 -173.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 93.8 p -68.91 -44.83 72.33 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.672 1.124 . . . . 1.1899999999999999 112.405 170.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 18.0 t -54.84 -41.46 70.77 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 120.428 1.467 . . . . 0.41999999999999998 111.603 173.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -63.23 -46.76 85.46 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.908 0.883 . . . . 2.1499999999999999 113.027 171.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -64.41 -27.35 68.94 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.597 1.159 . . . . 3.6200000000000001 112.671 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.2 m-30 -81.14 -25.8 36.61 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.061 1.744 . . . . 2.6299999999999999 112.09 171.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -81.69 -68.35 0.7 Allowed 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.765 1.626 . . . . 0.79000000000000004 112.228 -177.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.5 p 52.85 48.16 23.07 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.584 1.554 . . . . 1.0900000000000001 112.96 -175.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -77.81 -87.49 0.05 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.891 0.877 . . . . 2.79 112.934 174.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -148.8 -40.16 0.16 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.307 1.043 . . . . 3.7000000000000002 112.626 -168.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 40' ' ' SER . 18.0 mm -127.37 155.73 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.784 1.234 . . . . 2.6000000000000001 109.239 177.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmtp -56.35 97.88 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.058 0 CA-C-N 119.387 0.994 . . . . 1.78 111.049 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.15 27.71 65.7 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-O 117.516 -1.713 . . . . 0.89000000000000001 116.556 -178.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.432 ' HB3' ' HB ' ' A' ' 37' ' ' ILE . 78.5 p -52.81 -27.13 16.77 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 121.056 2.428 . . . . 1.3500000000000001 114.949 172.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -111.78 14.74 21.09 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.624 1.97 . . . . 2.6299999999999999 113.212 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 51.0 m -137.25 21.18 2.98 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 127.138 2.175 . . . . 0.58999999999999997 112.094 -174.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 m -59.04 -30.81 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 N-CA-C 113.149 0.796 . . . . 2.4199999999999999 113.149 -160.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -58.88 -33.48 70.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 119.708 1.14 . . . . 2.3300000000000001 112.983 -178.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -72.35 -40.59 67.23 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.445 0.698 . . . . 0.67000000000000004 111.929 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 -71.37 -35.28 71.04 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 121.121 -0.987 . . . . 2.2200000000000002 111.611 174.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.7 ttt85 -58.74 -44.96 90.65 Favored 'General case' 0 CA--C 1.526 0.044 0 C-N-CA 124.593 1.157 . . . . 3.77 110.647 171.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.67 -33.58 75.21 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.168 0.803 . . . . 0.56000000000000005 113.168 173.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 20.8 ttm -58.06 -50.58 72.95 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.374 -0.829 . . . . 3.02 111.145 172.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.32 -54.92 37.73 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 117.961 0.346 . . . . 3.1200000000000001 111.169 174.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.75 -26.21 56.74 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.907 2.083 . . . . 2.7400000000000002 114.673 -178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.9 t -86.63 -46.58 9.96 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.98 0.912 . . . . 0.79000000000000004 111.828 170.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 64.3 mtt -78.87 -19.39 52.06 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.341 -1.474 . . . . 2.3599999999999999 112.403 -167.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -62.37 -19.19 63.13 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.836 2.055 . . . . 1.8300000000000001 113.504 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -69.65 -51.3 36.05 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 125.172 1.389 . . . . 2.8300000000000001 112.299 178.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -113.13 122.58 35.38 Favored Pre-proline 0 N--CA 1.468 0.472 0 C-N-CA 123.374 0.67 . . . . 2.0800000000000001 111.526 -168.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -85.54 -26.11 1.42 Allowed 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 123.166 2.578 . . . . 2.3300000000000001 113.391 177.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -157.56 -0.05 0.11 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.075 1.139 . . . . 4.1200000000000001 114.075 -158.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.403 HD13 ' C ' ' A' ' 59' ' ' LEU . 0.0 OUTLIER -76.55 -8.94 58.21 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 126.616 1.966 . . . . 1.99 111.445 -167.657 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.935 0 C-N-CA 131.143 3.777 . . . . 2.9500000000000002 111.436 -173.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 66.8 mt-10 . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.586 0.232 . . . . 10.890000000000001 111.19 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 -73.66 -25.96 60.52 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.015 1.726 . . . . 8.6899999999999995 114.152 -176.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.3 t -123.1 133.31 54.3 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 126.004 1.722 . . . . 4.1100000000000003 111.965 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -164.4 -18.86 0.02 OUTLIER Glycine 0 CA--C 1.536 1.378 0 N-CA-C 116.554 1.382 . . . . 3.3799999999999999 116.554 -176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 30.6 t60 -57.23 -49.9 74.59 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.053 1.926 . . . . 5.4500000000000002 112.911 -173.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -70.32 -29.41 66.12 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.311 0.856 . . . . 2.73 113.311 171.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -38.95 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 CA-C-N 120.263 1.392 . . . . 2.0299999999999998 111.741 -177.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 69.1 mt-10 -66.32 -33.81 76.58 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.642 -0.694 . . . . 3.6800000000000002 111.56 171.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.98 -31.74 68.37 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 118.968 0.803 . . . . 1.1299999999999999 112.808 172.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -63.38 -52.17 62.78 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.991 -1.068 . . . . 1.27 109.61 172.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -56.71 -48.77 76.96 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.633 0.773 . . . . 3.52 111.191 173.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.05 -43.81 91.07 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 123.634 0.774 . . . . 4.4100000000000001 112.817 -174.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 59.8 p -71.37 -41.2 69.99 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.39 0.676 . . . . 2.1099999999999999 112.758 177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -71.98 -31.75 66.58 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.291 0.95 . . . . 2.9900000000000002 112.628 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -70.86 -33.7 70.89 Favored 'General case' 0 N--CA 1.479 0.993 0 CA-C-N 119.494 1.043 . . . . 6.5999999999999996 113.359 166.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.79 -34.71 78.51 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.983 1.265 . . . . 0.90000000000000002 111.643 172.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 7.8 tt -70.07 -44.29 69.4 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 118.755 -0.64 . . . . 4.1699999999999999 111.754 167.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.22 -27.68 60.59 Favored Glycine 0 CA--C 1.539 1.586 0 CA-C-N 119.735 1.152 . . . . 2.1600000000000001 114.326 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -76.63 -47.67 21.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 126.322 1.849 . . . . 4.1600000000000001 112.1 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -71.76 -29.45 64.51 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 125.733 1.613 . . . . 3.6699999999999999 115.318 -176.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 12.2 tt . . . . . 0 C--O 1.252 1.206 0 C-N-CA 126.293 1.837 . . . . 4.7400000000000002 113.205 -174.618 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 64.0 t30 . . . . . 0 N--CA 1.477 0.876 0 CA-C-O 119.642 -0.218 . . . . 4.25 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 112.47 -8.7 26.37 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 126.067 1.794 . . . . 2.3300000000000001 114.942 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -80.24 155.53 27.29 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.253 1.421 . . . . 3.46 114.267 -173.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.05 148.71 7.49 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 127.907 2.483 . . . . 2.6800000000000002 111.309 176.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.8 t30 -82.51 93.17 7.21 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 121.136 -0.977 . . . . 2.9100000000000001 111.156 161.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.55 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 31.0 m95 -76.3 -17.41 59.45 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.313 1.045 . . . . 1.3400000000000001 113.456 -176.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.48 143.19 46.49 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.188 1.795 . . . . 3.4100000000000001 111.281 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.1 t 62.61 150.57 0.1 Allowed Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 128.229 2.611 . . . . 5.4800000000000004 113.046 -163.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_exo -62.91 -0.44 2.08 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.217 2.612 . . . . 6.3499999999999996 117.46 -169.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.4 m -53.65 -58.3 7.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.697 1.999 . . . . 4.5899999999999999 113.458 -169.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp -95.03 -17.48 21.87 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 125.234 1.414 . . . . 1.8400000000000001 112.428 155.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -46.57 -43.24 15.1 Favored Glycine 0 CA--C 1.538 1.505 0 CA-C-N 120.115 1.325 . . . . 1.55 114.239 176.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.45 -22.25 55.96 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.179 1.489 . . . . 1.6399999999999999 114.97 174.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 5.6 tpt -99.88 -27.52 13.56 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.665 1.986 . . . . 2.25 113.772 171.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -106.43 -13.61 15.31 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 126.297 1.839 . . . . 0.73999999999999999 115.322 -166.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.7 m -96.12 -15.46 22.13 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 116.179 1.918 . . . . 3.8900000000000001 116.179 -173.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.19 -178.25 14.49 Favored Glycine 0 CA--C 1.546 2.026 0 C-N-CA 125.582 1.563 . . . . 1.1599999999999999 115.337 -168.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -42.39 -47.13 7.49 Favored 'Trans proline' 0 CA--C 1.539 0.73 1 C-N-CA 126.026 4.484 . . . . 1.5800000000000001 114.064 169.085 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.2 m -105.55 28.66 7.22 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.738 1.615 . . . . 1.29 111.817 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -61.5 -36.34 92.43 Favored Glycine 0 CA--C 1.524 0.635 0 O-C-N 120.752 -1.218 . . . . 0.64000000000000001 112.366 -173.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -55.45 -27.54 48.75 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.116 1.766 . . . . 2.8100000000000001 113.174 171.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -74.73 -32.05 62.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.84 1.256 . . . . 2.3399999999999999 109.065 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -70.96 -44.52 65.87 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 123.745 0.818 . . . . 1.74 112.49 166.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.55 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 32.0 mmtp -50.34 -54.53 20.89 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.378 0.671 . . . . 0.69999999999999996 109.755 173.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 30.6 t -57.08 -56.11 26.0 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.988 2.115 . . . . 0.55000000000000004 111.89 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.95 -51.35 56.27 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.785 -1.197 . . . . 0.48999999999999999 114.216 -177.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -77.66 -29.25 51.5 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-O 118.241 -0.885 . . . . 2.1200000000000001 112.303 -172.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -67.91 -45.8 73.37 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 119.426 1.012 . . . . 1.3500000000000001 111.148 165.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.0 t -54.79 -42.39 71.71 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.105 1.321 . . . . 0.56000000000000005 111.385 178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -61.71 -49.0 78.22 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.261 1.024 . . . . 2.2400000000000002 113.116 170.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -67.66 -20.94 65.37 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.183 1.179 . . . . 4.3899999999999997 114.183 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -83.32 -12.04 57.04 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.093 1.357 . . . . 2.71 111.335 170.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.8 t -105.46 -61.35 1.5 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.229 1.812 . . . . 0.95999999999999996 114.245 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 50.48 31.57 5.66 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 115.57 1.692 . . . . 1.5700000000000001 115.57 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -69.41 -68.54 0.4 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.679 1.592 . . . . 2.9399999999999999 114.187 -171.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -166.1 -48.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.618 1.167 . . . . 3.77 112.165 -170.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 40.1 mt -115.7 146.49 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 125.629 1.572 . . . . 3.0099999999999998 108.72 177.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -57.81 99.08 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.913 0.885 . . . . 2.6800000000000002 110.633 -178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.88 38.4 92.9 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 118.456 -1.191 . . . . 1.1599999999999999 114.951 -175.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.9 p -45.93 -31.21 2.07 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 120.046 1.923 . . . . 1.98 114.114 164.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -107.88 13.83 25.94 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 127.467 2.307 . . . . 2.3599999999999999 112.614 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -147.52 6.41 0.83 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.805 2.042 . . . . 0.66000000000000003 115.446 -169.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.7 p -60.28 -23.32 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.484 -1.385 . . . . 1.77 113.513 -166.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -66.35 -29.2 69.34 Favored 'General case' 0 CA--C 1.547 0.853 0 O-C-N 120.691 -1.256 . . . . 2.2200000000000002 112.95 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -69.26 -38.74 78.58 Favored 'General case' 0 CA--C 1.545 0.764 0 O-C-N 121.111 -0.993 . . . . 0.58999999999999997 110.998 174.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -64.99 -40.34 94.81 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 123.919 0.888 . . . . 2.4399999999999999 111.204 170.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttp85 -54.98 -43.48 73.58 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.74 0.816 . . . . 4.8300000000000001 111.103 175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.26 -44.9 86.59 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.881 1.067 . . . . 0.58999999999999997 113.881 171.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ttm -50.87 -57.74 7.72 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.623 0.769 . . . . 2.8999999999999999 111.258 176.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -58.7 -55.39 35.65 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.937 -0.554 . . . . 2.9500000000000002 110.271 175.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -48.61 -35.82 14.39 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 115.178 1.547 . . . . 3.6400000000000001 115.178 -177.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.3 t -91.33 -34.83 14.75 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.553 0.741 . . . . 0.92000000000000004 112.8 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 66.7 mtt -81.49 -25.84 35.67 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.21 0.914 . . . . 2.5499999999999998 111.332 -176.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -62.84 -22.49 66.7 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.381 1.873 . . . . 2.0699999999999998 112.523 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -66.23 -34.12 77.29 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.974 1.31 . . . . 5.2800000000000002 112.843 170.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.4 ' CG ' HD12 ' A' ' 59' ' ' LEU . 20.3 m-30 -124.42 110.99 28.24 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 123.759 0.824 . . . . 2.3399999999999999 113.079 -160.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -78.54 -50.49 0.08 OUTLIER 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.406 2.071 . . . . 2.4100000000000001 113.448 -171.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -163.8 52.55 0.15 Allowed 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 124.233 1.968 . . . . 4.5700000000000003 112.314 -171.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD12 ' CG ' ' A' ' 56' ' ' TYR 0.265 0.2 OUTLIER -91.19 -42.06 10.64 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 112.098 -2.319 . . . . 2.02 111.287 -163.764 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.291 0 C-N-CA 125.328 1.451 . . . . 2.8500000000000001 112.443 -151.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 88.2 mt-10 . . . . . 0 N--CA 1.482 1.165 0 CA-C-O 119.326 -0.369 . . . . 15.640000000000001 110.067 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 57.6 m-70 -94.72 72.03 3.58 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.878 1.271 . . . . 10.84 112.957 -171.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.6 136.34 40.5 Favored 'General case' 0 CA--C 1.543 0.684 0 O-C-N 120.823 -1.173 . . . . 4.7400000000000002 111.679 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.39 11.56 68.19 Favored Glycine 0 CA--C 1.54 1.625 0 O-C-N 120.929 -1.107 . . . . 4.0899999999999999 114.5 -178.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -94.29 -10.66 32.09 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.678 1.591 . . . . 4.6900000000000004 114.058 -172.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt -105.5 -23.97 12.7 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.814 1.246 . . . . 2.5499999999999998 112.218 -179.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.441 ' HA ' ' CD2' ' B' ' 70' ' ' HIS . 20.4 tt -67.76 -41.67 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 N-CA-C 115.758 1.762 . . . . 2.4900000000000002 115.758 -165.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -65.91 -32.2 73.56 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 120.73 -1.231 . . . . 5.8200000000000003 110.716 176.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -74.29 -27.1 60.57 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.878 1.271 . . . . 1.8200000000000001 113.8 169.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . 0.441 ' CD2' ' HA ' ' B' ' 67' ' ' ILE . 5.4 m-70 -59.66 -49.5 77.51 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-N 121.202 1.819 . . . . 1.24 109.565 166.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 30.6 mtpp -64.26 -44.38 91.94 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.93 0.892 . . . . 4.8399999999999999 111.385 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tp10 -61.95 -42.22 98.86 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.151 0.581 . . . . 4.1100000000000003 112.37 172.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 65.8 m -63.18 -45.89 89.67 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.076 0.853 . . . . 1.8500000000000001 112.476 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tpt -69.9 -34.39 73.45 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 118.66 -0.686 . . . . 6.5499999999999998 111.075 175.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -61.11 -46.25 91.38 Favored 'General case' 0 N--CA 1.479 1.024 0 CA-C-N 120.052 1.296 . . . . 5.21 111.681 170.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -65.44 -41.64 93.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.144 1.378 . . . . 1.75 112.915 179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 24.8 tp -67.23 -41.24 86.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.233 1.413 . . . . 3.1400000000000001 111.525 176.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.16 -39.1 96.82 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.689 1.138 . . . . 2.8300000000000001 112.883 172.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -65.81 -38.36 88.74 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.369 1.068 . . . . 5.0300000000000002 112.333 174.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 28.4 tptt -84.05 -39.18 19.91 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 114.453 1.279 . . . . 5.5499999999999998 114.453 -176.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.548 -1.691 . . . . 6.5999999999999996 112.115 -173.279 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 118.767 -0.635 . . . . 4.4800000000000004 111.425 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 101.55 10.56 40.78 Favored Glycine 0 CA--C 1.537 1.421 0 N-CA-C 116.278 1.271 . . . . 2.8999999999999999 116.278 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -62.37 153.41 31.19 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.8 1.8 . . . . 2.8799999999999999 112.995 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.454 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 2.1 mp -72.11 -48.38 49.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 C-N-CA 125.229 1.412 . . . . 2.4399999999999999 110.374 165.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 62.18 113.82 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.646 1.578 . . . . 2.4500000000000002 112.501 -161.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.514 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 46.3 m95 -97.79 10.66 39.56 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.465 1.506 . . . . 1.4299999999999999 114.121 -160.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -86.82 -15.83 38.03 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.358 1.463 . . . . 2.6499999999999999 114.222 -171.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 30.8 t -77.84 126.0 84.74 Favored Pre-proline 0 N--CA 1.471 0.61 0 CA-C-N 119.401 1.0 . . . . 4.4000000000000004 109.076 172.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -67.94 -29.18 34.83 Favored 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 121.781 1.654 . . . . 5.2000000000000002 115.408 -155.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 53.4 t -73.52 -49.52 26.12 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.527 1.058 . . . . 4.7999999999999998 112.689 -172.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.4 tt -67.73 -42.43 81.89 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.565 1.146 . . . . 2.4199999999999999 110.232 165.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.45 -34.29 54.66 Favored Glycine 0 CA--C 1.532 1.101 0 C-N-CA 124.493 1.044 . . . . 1.3 113.86 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -63.5 -41.75 99.15 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-N 118.414 1.107 . . . . 1.5600000000000001 113.303 172.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.9 tpt -64.56 -27.77 69.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.739 1.216 . . . . 2.54 112.054 171.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.582 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -94.18 10.99 31.7 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.516 1.527 . . . . 0.75 113.709 177.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.4 m -116.01 -166.47 1.15 Allowed 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.861 2.064 . . . . 1.3600000000000001 110.217 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.07 -175.37 54.6 Favored Glycine 0 CA--C 1.537 1.439 0 O-C-N 120.481 -1.387 . . . . 0.82999999999999996 114.857 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -40.41 -44.11 4.19 Favored 'Trans proline' 0 C--N 1.347 0.49 1 C-N-CA 125.445 4.097 . . . . 1.05 115.713 166.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.6 m -113.91 15.0 18.62 Favored 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 114.028 1.121 . . . . 0.65000000000000002 114.028 -162.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.31 -52.85 7.04 Favored Glycine 0 N--CA 1.469 0.861 0 C-N-CA 123.63 0.633 . . . . 0.56999999999999995 113.024 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -66.34 -20.06 65.98 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 115.405 1.631 . . . . 4.8899999999999997 115.405 -179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -67.91 -38.45 82.95 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 120.05 1.295 . . . . 0.94999999999999996 109.901 168.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -68.37 -43.51 77.23 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 119.048 -0.501 . . . . 2.02 112.311 173.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.582 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -55.11 -50.94 67.93 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 121.428 0.632 . . . . 0.73999999999999999 109.388 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.9 t -66.0 -44.66 84.15 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.564 1.545 . . . . 0.55000000000000004 113.207 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -66.21 -52.07 51.5 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.421 1.009 . . . . 0.28999999999999998 112.891 179.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.72 -30.27 61.47 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 117.98 -1.01 . . . . 1.97 112.54 -177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.6 t -61.44 -51.47 68.57 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.527 1.058 . . . . 1.77 110.897 166.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.9 t -56.62 -39.84 74.33 Favored 'General case' 0 CA--C 1.545 0.769 0 O-C-N 121.301 -0.874 . . . . 0.46999999999999997 111.222 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -61.96 -44.41 96.81 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 124.053 0.941 . . . . 2.0899999999999999 113.375 169.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -67.48 -21.85 65.5 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 115.023 1.49 . . . . 3.54 115.023 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -94.52 -0.64 54.48 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.492 1.117 . . . . 2.8999999999999999 113.621 167.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.3 t -107.74 -63.15 1.34 Allowed 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.797 1.639 . . . . 0.96999999999999997 113.322 -177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 29.7 p 51.5 28.43 4.54 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 127.256 2.222 . . . . 1.45 114.855 178.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -63.78 -73.61 0.11 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.438 1.495 . . . . 2.4900000000000002 114.084 -166.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -163.16 -43.08 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 125.905 1.682 . . . . 4.3600000000000003 112.09 -160.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.0 mt -132.33 154.74 40.55 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.697 2.399 . . . . 2.0499999999999998 107.891 175.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -48.27 89.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 127.098 2.159 . . . . 2.2200000000000002 112.242 -179.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.08 39.98 98.67 Favored Glycine 0 CA--C 1.535 1.33 0 CA-C-O 117.692 -1.616 . . . . 0.87 114.79 -174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.6 p -56.44 -12.62 1.78 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 120.873 2.337 . . . . 1.28 115.903 171.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -114.04 23.13 13.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 126.562 1.945 . . . . 2.29 112.282 171.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 76.7 m -148.94 12.0 0.85 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 0.45000000000000001 112.369 -171.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 5.0 m -61.29 -27.89 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-N 119.327 0.967 . . . . 1.9099999999999999 113.156 -160.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.3 -26.5 68.45 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.011 0.924 . . . . 1.9199999999999999 113.483 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -70.51 -42.34 71.44 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.846 -1.159 . . . . 0.55000000000000004 111.476 173.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -70.45 -34.94 73.01 Favored 'General case' 0 N--CA 1.469 0.498 0 O-C-N 121.365 -0.834 . . . . 1.73 111.216 174.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -57.82 -44.29 86.3 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.859 1.264 . . . . 3.6699999999999999 110.992 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -67.22 -37.19 83.16 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 124.244 0.965 . . . . 0.47999999999999998 113.604 172.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 56.0 ttp -61.39 -45.49 94.12 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.157 -0.964 . . . . 2.2999999999999998 111.817 176.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -61.01 -52.11 66.38 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 122.656 0.382 . . . . 3.7599999999999998 110.714 171.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 18.5 tt0 -56.83 -26.26 57.82 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.123 2.169 . . . . 2.6899999999999999 115.592 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 47.3 t -87.65 -47.16 8.89 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.597 0.759 . . . . 0.68999999999999995 111.584 170.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 59.2 mtt -75.42 -23.89 57.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 120.322 -1.486 . . . . 2.29 111.014 -167.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.5 pp0? -57.93 -19.2 28.25 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.314 1.845 . . . . 1.48 113.818 171.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.6 mtmt -74.6 -20.04 60.08 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 116.279 1.955 . . . . 2.7200000000000002 116.279 173.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -140.37 116.45 7.82 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 118.991 0.814 . . . . 2.1200000000000001 111.758 -164.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -75.05 -53.33 0.1 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 121.504 1.469 . . . . 2.23 113.573 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -162.77 64.66 0.2 Allowed 'General case' 0 N--CA 1.478 0.963 0 CA-C-O 124.598 2.142 . . . . 4.6100000000000003 110.151 -173.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.272 1.1 tm? -116.02 -13.3 11.24 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 110.92 -2.854 . . . . 2.1099999999999999 110.755 -156.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 7.2 p90 . . . . . 0 C--O 1.257 1.46 0 C-N-CA 128.193 2.597 . . . . 2.7799999999999998 111.683 -167.405 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.476 0.861 0 N-CA-C 111.07 0.026 . . . . 17.68 111.07 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 19.4 m80 55.43 53.99 9.12 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.617 1.967 . . . . 16.32 113.545 171.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 24.5 p -65.41 -7.94 16.35 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 116.553 2.057 . . . . 7.7999999999999998 116.553 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 179.79 -170.75 42.16 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 126.062 1.791 . . . . 4.4900000000000002 111.7 176.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -88.72 -37.58 15.39 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.136 1.161 . . . . 5.9000000000000004 114.136 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . 0.508 HD23 ' H ' ' B' ' 66' ' ' LEU 0.311 2.5 pt? -77.57 -21.18 52.88 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.413 1.264 . . . . 2.7999999999999998 114.413 -177.105 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 8.1 tp -59.0 -41.76 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.375 1.443 . . . . 2.3599999999999999 111.881 167.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 37.2 tp10 -69.37 -25.47 64.19 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 118.415 -0.802 . . . . 5.6100000000000003 111.789 171.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.94 -35.74 72.33 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 120.498 1.499 . . . . 1.73 113.099 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -65.28 -45.06 85.98 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 120.381 -1.449 . . . . 1.3700000000000001 110.266 172.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -60.13 -48.47 81.6 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.371 1.068 . . . . 3.4700000000000002 111.548 173.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.25 -38.61 68.73 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.89 1.676 . . . . 6.9500000000000002 112.241 172.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 8.0 m -59.08 -59.48 5.39 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 121.559 -0.713 . . . . 2.77 110.511 173.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -71.16 -30.09 66.02 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.155 1.169 . . . . 3.0600000000000001 114.155 -175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 42.6 ttm105 -66.38 -45.02 81.48 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.434 1.894 . . . . 6.7599999999999998 111.347 174.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.05 -35.57 76.73 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.398 0.679 . . . . 1.5800000000000001 112.344 175.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.2 tp -59.71 -55.87 28.94 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 118.862 0.755 . . . . 3.7999999999999998 110.145 168.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -55.9 -35.64 64.2 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.185 0.898 . . . . 2.29 113.345 -178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -65.63 -59.52 3.85 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.283 1.433 . . . . 5.5599999999999996 112.001 172.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.52 -9.42 59.77 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 115.568 1.692 . . . . 5.8200000000000003 115.568 -172.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.7 tt . . . . . 0 C--O 1.253 1.242 0 CA-C-O 117.173 -1.394 . . . . 3.6200000000000001 112.322 169.185 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 N--CA 1.484 1.249 0 CA-C-O 121.461 0.648 . . . . 5.6900000000000004 112.724 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.69 -2.56 2.48 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 126.117 1.817 . . . . 2.9900000000000002 116.454 178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -102.43 171.63 7.34 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.073 1.436 . . . . 3.4300000000000002 114.041 -163.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.442 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -66.18 -44.53 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 C-N-CA 124.968 1.307 . . . . 2.27 112.544 166.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 62.9 105.38 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.073 2.149 . . . . 3.1200000000000001 112.588 -159.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.561 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 76.9 m95 -91.19 23.86 3.12 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.399 1.48 . . . . 1.21 114.462 -158.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -97.65 151.95 19.58 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.588 0.959 . . . . 2.8700000000000001 113.588 -170.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . 0.251 0.0 OUTLIER 62.73 156.17 0.12 Allowed Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 126.59 1.956 . . . . 4.8099999999999996 113.723 -164.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.03 25.11 0.57 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 122.925 2.417 . . . . 5.4299999999999997 114.998 -164.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.64 -66.28 0.72 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.264 1.425 . . . . 3.3599999999999999 110.45 169.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mp -95.36 -23.09 17.33 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-O 117.82 -1.086 . . . . 1.5 112.365 160.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.23 -30.88 68.21 Favored Glycine 0 CA--C 1.534 1.231 0 CA-C-N 120.799 1.636 . . . . 1.04 116.176 -166.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.35 -50.14 8.62 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 118.491 1.146 . . . . 1.3400000000000001 112.32 170.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 30.9 tpp -58.43 -31.74 68.02 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.391 1.477 . . . . 2.1800000000000002 112.664 177.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -91.54 -2.63 57.09 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.472 2.709 . . . . 0.65000000000000002 113.792 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 m -102.78 179.79 4.18 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.914 1.686 . . . . 1.1899999999999999 110.615 167.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.98 -179.41 41.11 Favored Glycine 0 CA--C 1.539 1.569 0 O-C-N 121.078 -1.013 . . . . 0.88 114.432 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -48.5 -32.65 21.3 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 125.266 3.977 . . . . 1.54 115.243 173.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 31.3 m -121.65 17.67 11.18 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.015 1.326 . . . . 0.76000000000000001 112.146 -171.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.4 -44.97 85.09 Favored Glycine 0 CA--C 1.525 0.66 0 C-N-CA 123.977 0.799 . . . . 0.70999999999999996 111.148 -177.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -58.26 -29.33 65.7 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.681 1.992 . . . . 3.1099999999999999 113.652 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -72.35 -32.38 66.43 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.6 -0.688 . . . . 0.81000000000000005 110.773 174.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.7 t80 -68.87 -42.46 76.97 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 118.423 0.556 . . . . 1.6799999999999999 112.365 168.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.0 mmtp -50.37 -53.95 25.32 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.722 0.772 . . . . 0.55000000000000004 109.748 174.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 37.9 t -65.12 -49.18 70.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 126.795 2.038 . . . . 0.44 113.397 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.15 -48.24 65.88 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.979 -1.076 . . . . 0.38 113.192 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -78.01 -27.32 48.9 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.11 -0.948 . . . . 2.0099999999999998 112.444 -177.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.8 t -59.33 -55.26 37.01 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 119.937 1.244 . . . . 1.73 110.768 161.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.5 t -54.18 -41.71 68.86 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 121.738 -0.601 . . . . 0.40000000000000002 111.242 -179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -65.45 -43.11 91.42 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.159 1.384 . . . . 2.3100000000000001 114.592 173.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -68.63 -25.03 64.64 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.627 1.103 . . . . 2.8700000000000001 113.552 178.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -83.77 -31.71 25.79 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.021 0.928 . . . . 2.8500000000000001 112.912 166.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.8 t -63.77 -57.66 9.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.355 1.062 . . . . 0.72999999999999998 112.599 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 67.8 p 52.5 38.05 24.53 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.505 1.522 . . . . 1.3600000000000001 114.583 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -83.82 -73.31 0.42 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 114.513 1.301 . . . . 2.54 114.513 -173.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -172.61 -38.69 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.816 1.246 . . . . 5.0099999999999998 112.642 176.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -114.67 152.64 16.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.884 1.674 . . . . 1.8100000000000001 109.817 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -64.14 108.0 1.43 Allowed 'General case' 0 N--CA 1.474 0.748 0 O-C-N 121.155 -0.966 . . . . 1.8600000000000001 109.384 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 84.15 13.06 75.12 Favored Glycine 0 CA--C 1.533 1.157 0 CA-C-O 117.685 -1.619 . . . . 1.79 116.557 174.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.7 p -58.57 -15.12 10.0 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 120.945 2.372 . . . . 1.53 115.721 176.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -129.86 16.87 5.74 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.669 1.188 . . . . 2.25 112.97 163.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.3 m -143.53 11.83 1.7 Allowed 'General case' 0 CA--C 1.544 0.73 0 O-C-N 120.564 -1.335 . . . . 0.41999999999999998 114.356 -169.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.3 p -57.43 -31.11 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.188 1.395 . . . . 1.7 114.124 -170.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -59.54 -30.15 68.41 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 120.614 1.552 . . . . 2.4700000000000002 113.745 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -72.52 -40.59 66.67 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.229 -0.92 . . . . 0.96999999999999997 112.075 175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -68.92 -35.17 76.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.984 -1.072 . . . . 1.74 111.304 173.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 29.8 ttp180 -61.36 -40.3 93.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 118.334 -0.841 . . . . 5.3099999999999996 111.508 169.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.418 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -65.39 -33.77 76.73 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 113.626 0.973 . . . . 0.62 113.626 171.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 89.5 mtp -55.95 -52.29 64.67 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 119.436 1.016 . . . . 2.0499999999999998 110.582 167.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.6 tm0? -60.82 -52.06 66.67 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 118.675 0.67 . . . . 4.1799999999999997 111.531 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 2.8 tt0 -58.37 -23.05 55.86 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 128.388 2.675 . . . . 2.75 114.598 177.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -88.18 -43.78 11.37 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.958 0.903 . . . . 0.79000000000000004 112.658 168.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 95.1 mtp -78.26 -22.29 48.58 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 120.547 -1.346 . . . . 3.5299999999999998 110.722 -167.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -55.03 -23.8 21.53 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.038 1.735 . . . . 2.0099999999999998 113.215 169.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.9 mmmt -57.49 -39.83 77.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.076 0.951 . . . . 3.3700000000000001 113.067 169.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -146.87 121.06 5.13 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 113.774 1.027 . . . . 2.8100000000000001 113.774 -158.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -85.17 -35.1 0.16 Allowed 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 121.947 1.765 . . . . 2.6499999999999999 114.673 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -162.32 66.5 0.23 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 123.125 1.44 . . . . 4.0099999999999998 111.488 -165.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.495 ' O ' HD22 ' A' ' 59' ' ' LEU 0.255 0.1 OUTLIER -128.4 -13.56 4.89 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-N 113.79 -1.55 . . . . 2.21 111.621 -161.648 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.162 0 C-N-CA 127.079 2.152 . . . . 3.23 110.946 -163.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.448 0.642 . . . . 9.8000000000000007 110.858 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -78.89 -29.89 44.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.877 -0.514 . . . . 12.17 111.187 167.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 65.47 36.83 6.46 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 125.133 1.373 . . . . 4.8499999999999996 113.467 177.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -60.1 -14.04 30.28 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 126.412 1.958 . . . . 3.75 115.772 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -55.62 -27.59 50.41 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.57 1.148 . . . . 6.5099999999999998 113.214 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.292 0.9 OUTLIER -138.11 -23.96 1.01 Allowed 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.943 1.46 . . . . 2.8500000000000001 114.943 165.257 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 5.0 tt -66.61 -25.48 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-N 122.289 2.313 . . . . 1.9199999999999999 113.894 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -63.49 -43.95 95.77 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.184 -0.947 . . . . 3.4399999999999999 110.729 173.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.07 -37.33 81.14 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.981 0.912 . . . . 1.3200000000000001 111.46 173.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 -64.45 -46.38 83.37 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.844 1.202 . . . . 1.4299999999999999 112.391 177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -62.83 -47.42 83.49 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.711 0.804 . . . . 4.9500000000000002 110.66 176.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -55.64 -45.22 77.65 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.842 0.682 . . . . 4.7300000000000004 112.842 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.6 m -63.81 -50.14 70.13 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.42 1.088 . . . . 2.0499999999999998 111.462 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -23.67 52.91 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.286 0.847 . . . . 3.6899999999999999 113.286 -175.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -70.56 -44.15 68.03 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.479 1.036 . . . . 7.9800000000000004 112.008 164.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.13 -48.42 81.69 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 119.297 0.953 . . . . 1.4299999999999999 111.626 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.87 -41.93 88.21 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.434 -0.791 . . . . 3.5699999999999998 111.172 171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -54.49 -36.86 59.12 Favored Glycine 0 CA--C 1.535 1.344 0 CA-C-N 118.954 0.797 . . . . 2.0499999999999998 114.387 171.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -80.98 -19.01 44.97 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.037 1.418 . . . . 6.2300000000000004 114.029 172.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -80.97 -24.12 38.28 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 115.476 1.658 . . . . 4.6399999999999997 115.476 168.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 mm . . . . . 0 N--CA 1.492 1.659 0 CA-C-N 121.279 1.854 . . . . 4.1200000000000001 111.773 177.868 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 31.7 t30 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 119.024 -0.512 . . . . 4.5 112.036 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.54 22.67 76.64 Favored Glycine 0 CA--C 1.532 1.121 0 CA-C-N 119.069 0.849 . . . . 2.96 114.074 177.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -93.19 161.75 14.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 125.935 1.694 . . . . 4.5199999999999996 113.274 -165.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.1 mp -125.85 -48.47 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 125.006 1.322 . . . . 2.5299999999999998 111.937 172.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.7 t30 61.59 104.71 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.32 2.248 . . . . 3.0099999999999998 111.295 -161.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.523 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 83.4 m95 -89.01 59.16 4.88 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.42 1.488 . . . . 1.29 112.111 -155.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -146.81 159.83 43.02 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 113.334 -1.757 . . . . 3.98 110.905 -148.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.2 p 58.76 -176.52 0.03 OUTLIER Pre-proline 0 CA--C 1.558 1.287 0 C-N-CA 125.683 1.593 . . . . 4.7400000000000002 114.662 -172.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -80.7 53.55 4.83 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 123.681 2.921 . . . . 5.9699999999999998 112.611 -173.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 84.5 m -126.7 -98.49 0.4 Allowed 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.958 2.103 . . . . 4.54 111.732 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.3 mp -91.22 -14.14 31.54 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 121.007 1.731 . . . . 1.79 113.406 178.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.64 53.4 Favored Glycine 0 CA--C 1.541 1.681 0 CA-C-N 120.628 1.558 . . . . 1.3300000000000001 116.135 -167.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -75.76 -23.47 72.38 Favored Glycine 0 CA--C 1.538 1.483 0 CA-C-N 118.781 1.29 . . . . 1.48 114.726 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.2 tpp -71.71 -38.78 70.48 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.753 1.621 . . . . 4.0899999999999999 111.743 168.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' O ' ' HE3' ' A' ' 24' ' ' LYS . . . -89.07 -9.42 51.25 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 128.317 2.647 . . . . 1.0700000000000001 114.516 -175.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.3 m -101.8 150.82 22.77 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.002 1.321 . . . . 1.8600000000000001 110.946 173.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.24 175.81 15.64 Favored Glycine 0 CA--C 1.539 1.546 0 C-N-CA 124.087 0.851 . . . . 1.1100000000000001 114.686 -179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -47.59 -37.86 27.46 Favored 'Trans proline' 0 CA--C 1.535 0.575 1 C-N-CA 125.781 4.321 . . . . 1.3100000000000001 114.504 175.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.5 m -109.23 12.42 24.91 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.908 1.283 . . . . 1.0900000000000001 112.583 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.56 -44.54 95.45 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 124.076 0.846 . . . . 1.29 111.656 -175.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -57.11 -26.13 59.96 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 127.091 2.156 . . . . 4.1200000000000001 114.663 172.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -73.1 -34.87 66.43 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.512 0.597 . . . . 1.0600000000000001 110.738 171.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.25 -43.62 90.75 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 118.687 0.676 . . . . 1.9299999999999999 111.722 167.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.523 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.1 mmtp -52.43 -51.65 58.06 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.641 0.734 . . . . 0.96999999999999997 110.299 175.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.7 t -64.56 -45.06 88.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.558 1.943 . . . . 0.79000000000000004 112.908 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.08 -52.89 29.95 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.29 1.036 . . . . 0.31 113.085 178.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -33.38 65.28 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.446 -0.788 . . . . 2.0699999999999998 112.574 -177.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.3 p -64.02 -48.71 75.26 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-N 119.678 1.126 . . . . 1.4099999999999999 111.114 168.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 37.1 t -55.67 -41.7 74.06 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.042 1.292 . . . . 0.57999999999999996 111.592 176.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -63.14 -42.6 99.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.241 1.016 . . . . 2.2400000000000002 113.159 173.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -67.02 -28.52 68.3 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 119.59 1.086 . . . . 2.7599999999999998 113.139 174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -72.99 -21.35 60.86 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.745 1.218 . . . . 3.02 112.685 167.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 12.0 t -88.19 -57.09 3.06 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.241 1.416 . . . . 1.25 113.86 -170.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.258 65.9 p 41.3 47.85 3.07 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 126.194 1.798 . . . . 1.79 114.867 -172.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.91 -71.07 0.42 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.674 1.19 . . . . 2.7799999999999998 113.117 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -171.78 -46.82 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 125.433 1.493 . . . . 2.6099999999999999 112.242 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 23.4 mt -113.91 157.05 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.202 1.401 . . . . 1.71 109.4 -173.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -58.95 106.48 0.42 Allowed 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.504 -0.748 . . . . 1.6599999999999999 110.872 177.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.403 ' HA2' ' HB2' ' A' ' 42' ' ' CYS . . . 64.53 27.55 71.97 Favored Glycine 0 CA--C 1.528 0.877 0 CA-C-O 117.586 -1.675 . . . . 1.03 115.808 177.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 79.7 p -57.83 -15.63 9.02 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 120.349 2.074 . . . . 1.3700000000000001 114.181 171.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -126.25 30.1 5.68 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.753 1.221 . . . . 2.3700000000000001 113.53 166.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.403 ' HB2' ' HA2' ' A' ' 39' ' ' GLY . 56.7 m -147.88 11.87 0.97 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.779 1.632 . . . . 0.53000000000000003 114.561 -178.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -53.81 -29.16 17.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 114.647 1.351 . . . . 1.8100000000000001 114.647 -170.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.94 -24.2 65.87 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 121.771 2.078 . . . . 2.2400000000000002 113.687 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -81.71 -41.76 20.84 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.39 1.076 . . . . 0.68999999999999995 112.172 176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -64.36 -37.63 88.18 Favored 'General case' 0 N--CA 1.477 0.89 0 O-C-N 120.62 -1.3 . . . . 1.8899999999999999 110.276 171.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.7 ttp180 -62.19 -38.64 89.86 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 126.129 1.771 . . . . 5.5099999999999998 112.508 169.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -62.55 -35.2 78.71 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 119.395 0.998 . . . . 0.89000000000000001 113.351 167.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 14.4 ttt -61.41 -49.06 78.38 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 119.749 1.159 . . . . 3.5299999999999998 112.004 171.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.0 tp60 -55.88 -53.47 56.41 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 118.273 0.488 . . . . 3.8900000000000001 111.808 172.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 5.4 tt0 -56.57 -29.16 61.73 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.539 2.336 . . . . 3.48 113.978 178.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 53.0 t -80.62 -42.62 21.86 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.391 1.076 . . . . 0.90000000000000002 111.199 172.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 93.6 mtp -74.33 -30.71 62.16 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.679 -1.263 . . . . 4.7199999999999998 111.269 -170.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -71.81 -13.83 61.8 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.925 2.09 . . . . 3.1200000000000001 114.019 178.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -80.89 -24.71 38.08 Favored 'General case' 0 N--CA 1.479 1.015 0 N-CA-C 113.678 0.992 . . . . 4.1900000000000004 113.678 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -120.31 118.28 31.3 Favored Pre-proline 0 C--O 1.237 0.446 0 N-CA-C 113.533 0.938 . . . . 3.46 113.533 -169.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -77.57 -26.76 6.81 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 C-N-CA 122.704 2.269 . . . . 5.3600000000000003 113.364 166.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -166.54 1.08 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 120.517 1.508 . . . . 8.7899999999999991 115.017 -151.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.58 -5.45 29.26 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.798 1.639 . . . . 4.96 113.604 -170.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 . . . . . 0 C--O 1.253 1.28 0 C-N-CA 129.141 2.976 . . . . 5.3200000000000003 113.562 -163.661 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 . . . . . 0 N--CA 1.481 1.093 0 CA-C-O 118.998 -0.525 . . . . 16.300000000000001 110.157 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 78.6 t60 -71.93 81.19 0.92 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.219 1.408 . . . . 16.66 113.006 -172.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 26.1 p -167.36 162.59 14.84 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.534 1.933 . . . . 9.8000000000000007 110.998 176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -173.6 -95.01 0.1 OUTLIER Glycine 0 CA--C 1.531 1.086 0 O-C-N 121.279 -0.888 . . . . 6.4000000000000004 113.527 172.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -53.32 -17.41 1.8 Allowed 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 115.648 1.721 . . . . 6.9100000000000001 115.648 -176.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.6 pp -59.72 -23.43 63.16 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.281 1.215 . . . . 3.6200000000000001 114.281 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 7.4 tt -69.32 -41.79 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 120.36 1.436 . . . . 3.7999999999999998 113.259 -175.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -70.16 -37.61 75.23 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 120.821 -1.174 . . . . 5.3600000000000003 110.636 175.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -63.02 -52.37 63.17 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.425 0.69 . . . . 2.3500000000000001 111.876 176.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -70.94 -27.93 64.11 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 113.347 0.869 . . . . 2.98 113.347 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 56.5 tptt -63.86 -45.01 91.37 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 119.303 0.956 . . . . 4.0 111.59 167.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.64 -32.46 73.17 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.646 1.112 . . . . 3.7200000000000002 113.967 175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 89.4 p -77.75 -37.03 50.03 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.813 1.188 . . . . 1.6799999999999999 113.36 176.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 16.7 ptm -71.37 -23.88 61.97 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.289 1.404 . . . . 3.7999999999999998 112.886 170.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? -67.41 -50.22 60.43 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.995 0.918 . . . . 7.0800000000000001 111.066 166.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.97 97.03 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 112.516 0.561 . . . . 1.75 112.516 177.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.19 -49.37 77.89 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.396 0.678 . . . . 4.0499999999999998 110.771 171.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.78 -28.53 63.22 Favored Glycine 0 CA--C 1.536 1.403 0 CA-C-O 119.349 -0.695 . . . . 3.3199999999999998 114.5 177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -79.13 -39.79 32.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.889 1.676 . . . . 3.96 113.311 173.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -81.96 -23.04 36.32 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 115.151 1.537 . . . . 4.7400000000000002 115.151 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 13.2 tt . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.6 -1.191 . . . . 4.9699999999999998 113.216 -175.345 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 118.391 -0.814 . . . . 4.5899999999999999 112.229 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.28 27.84 67.26 Favored Glycine 0 CA--C 1.538 1.469 0 CA-C-N 120.631 1.56 . . . . 2.71 113.683 -170.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -136.06 166.73 22.69 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 114.46 1.282 . . . . 3.2599999999999998 114.46 -169.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.57 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.6 mp -121.57 -46.23 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 125.277 1.431 . . . . 2.5499999999999998 113.404 -159.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.6 t30 69.98 74.99 0.22 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.569 1.948 . . . . 3.0899999999999999 112.687 -162.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.57 ' CE3' HG21 ' A' ' 4' ' ' ILE . 38.2 m95 -63.96 -20.12 65.64 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 126.059 1.744 . . . . 1.6899999999999999 113.799 -173.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -61.63 -18.58 60.06 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 126.454 1.902 . . . . 2.6800000000000002 113.567 174.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 67.0 m -75.24 127.25 86.77 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 124.377 1.071 . . . . 4.0199999999999996 111.386 177.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -57.14 -19.02 31.7 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 124.114 3.209 . . . . 4.6900000000000004 116.822 -171.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 p -53.23 -48.19 68.39 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.51 1.124 . . . . 4.04 112.865 168.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.45 HD22 ' CG2' ' A' ' 4' ' ' ILE . 8.0 mp -103.34 -18.11 14.99 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.263 1.025 . . . . 1.3400000000000001 112.544 174.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.58 -19.81 54.92 Favored Glycine 0 CA--C 1.534 1.258 0 N-CA-C 116.758 1.463 . . . . 1.74 116.758 -171.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -91.7 -21.73 33.18 Favored Glycine 0 CA--C 1.536 1.382 0 CA-C-N 118.852 1.326 . . . . 1.73 114.921 174.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.7 tpt -104.91 -35.62 7.63 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.108 1.363 . . . . 2.6299999999999999 113.014 -178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.77 -3.91 40.7 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.286 1.834 . . . . 0.83999999999999997 112.969 168.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.9 m -107.58 151.19 25.94 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.993 1.317 . . . . 1.3400000000000001 110.898 163.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 133.43 -177.34 19.07 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 123.964 0.792 . . . . 0.85999999999999999 114.134 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -44.49 -30.47 3.92 Favored 'Trans proline' 0 C--N 1.348 0.504 1 C-N-CA 125.36 4.04 . . . . 1.24 116.118 163.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.8 m -125.5 20.6 7.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.415 1.086 . . . . 0.76000000000000001 112.739 -168.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -40.11 -54.79 3.05 Favored Glycine 0 N--CA 1.469 0.857 0 C-N-CA 124.371 0.986 . . . . 0.68999999999999995 112.742 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -65.32 -23.14 66.93 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.935 1.458 . . . . 4.0899999999999999 114.935 -176.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -70.15 -34.89 73.58 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.624 1.102 . . . . 1.1200000000000001 110.365 171.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -67.77 -45.21 75.53 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 119.24 -0.409 . . . . 1.8899999999999999 111.876 170.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.543 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -54.22 -53.05 58.76 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.938 0.875 . . . . 0.83999999999999997 110.579 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.0 t -70.32 -36.21 74.14 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 126.154 1.782 . . . . 0.84999999999999998 112.396 -175.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.4 -53.05 48.86 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 120.755 -1.216 . . . . 0.31 112.923 172.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -74.49 -33.08 62.75 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 2.7799999999999998 112.378 -174.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.0 t -60.11 -54.8 41.63 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 118.725 -0.655 . . . . 1.78 109.951 166.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 17.0 t -56.11 -40.28 73.47 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 120.088 1.313 . . . . 0.42999999999999999 111.582 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -56.98 -46.08 82.49 Favored 'General case' 0 CA--C 1.546 0.822 0 O-C-N 120.84 -1.162 . . . . 1.95 112.917 169.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.1 m80 -70.45 -17.41 62.99 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 115.092 1.516 . . . . 3.4300000000000002 115.092 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -87.87 -2.84 58.86 Favored 'General case' 0 CA--C 1.554 1.113 0 C-N-CA 124.938 1.295 . . . . 2.46 113.2 165.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.9 t -110.2 -60.6 1.78 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.193 1.797 . . . . 0.60999999999999999 112.586 -176.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 54.4 p 58.44 17.35 4.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 127.291 2.237 . . . . 1.25 116.302 174.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.55 -66.96 0.46 Allowed 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.87 1.433 . . . . 2.8799999999999999 114.87 -166.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -168.58 -48.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 126.41 1.884 . . . . 3.1000000000000001 109.584 -179.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.0 mt -100.77 150.08 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 126.232 1.813 . . . . 1.77 108.33 -178.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -57.49 88.48 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.735 1.214 . . . . 1.5700000000000001 112.417 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 52.95 51.17 47.47 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 117.944 -1.475 . . . . 1.3600000000000001 113.333 -175.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 t -55.33 -34.14 63.96 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 120.393 2.097 . . . . 2.9100000000000001 113.279 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -78.49 -8.08 58.16 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 125.997 1.719 . . . . 2.1800000000000002 113.738 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 94.7 m -116.18 10.35 14.9 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 128.563 2.745 . . . . 0.51000000000000001 113.148 -174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 14.3 p -55.6 -25.75 18.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.853 1.261 . . . . 1.46 113.715 -173.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -64.97 -26.02 68.12 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-N 120.143 1.338 . . . . 1.8400000000000001 112.624 176.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -77.33 -39.82 46.37 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.945 0.898 . . . . 0.73999999999999999 112.618 170.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.3 m-85 -65.68 -38.89 90.54 Favored 'General case' 0 N--CA 1.475 0.817 0 O-C-N 120.864 -1.148 . . . . 2.02 110.748 173.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -67.51 -37.84 83.39 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 116.959 -1.496 . . . . 4.4100000000000001 111.844 173.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.41 -37.85 82.15 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.448 1.022 . . . . 0.70999999999999996 113.154 168.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.6 ttm -58.68 -51.16 71.1 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.533 -0.73 . . . . 2.5899999999999999 110.413 173.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.2 tm0? -63.1 -48.12 79.93 Favored 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 112.198 0.444 . . . . 3.5800000000000001 112.198 177.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -59.77 -29.17 68.01 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.459 2.704 . . . . 2.6699999999999999 114.191 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 52.8 t -86.15 -41.67 14.51 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.177 0.591 . . . . 0.96999999999999997 111.105 170.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 53.0 mtt -75.97 -22.78 55.53 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 120.562 -1.336 . . . . 2.0600000000000001 111.832 -168.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -58.74 -15.36 11.76 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 126.253 1.821 . . . . 1.6000000000000001 113.369 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 45.6 mtmt -70.25 -27.65 64.61 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.357 1.463 . . . . 4.0199999999999996 114.877 172.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 91.7 m-85 -142.33 121.68 7.85 Favored Pre-proline 0 CA--C 1.538 0.501 0 C-N-CA 124.251 1.021 . . . . 2.5299999999999998 111.434 -170.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -77.78 -47.02 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 121.928 1.752 . . . . 2.3799999999999999 113.312 -170.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -158.34 52.96 0.43 Allowed 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 124.074 1.892 . . . . 3.79 113.542 -165.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.271 0.5 OUTLIER -116.71 -10.4 11.13 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 127.056 2.143 . . . . 1.8799999999999999 111.463 -157.156 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 60' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.256 1.404 0 C-N-CA 125.941 1.696 . . . . 3.0499999999999998 112.74 -165.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.483 1.222 0 N-CA-C 112.549 0.574 . . . . 14.140000000000001 112.549 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 69.1 m-70 -139.87 -4.12 1.4 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.704 2.001 . . . . 9.1300000000000008 114.72 177.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.1 t 63.69 -23.58 0.07 Allowed 'General case' 0 CA--C 1.557 1.244 0 N-CA-C 117.574 2.435 . . . . 7.0099999999999998 117.574 176.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.37 -170.51 31.39 Favored Glycine 0 CA--C 1.54 1.636 0 C-N-CA 125.534 1.54 . . . . 5.5499999999999998 115.333 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 -79.07 -2.33 39.96 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 116.016 1.858 . . . . 4.8300000000000001 116.016 -170.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -54.81 -27.61 43.1 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 115.009 1.485 . . . . 2.4199999999999999 115.009 -169.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -67.84 -32.14 55.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 C-N-CA 124.562 1.145 . . . . 2.6299999999999999 112.435 179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -60.04 -46.24 90.18 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.082 -1.011 . . . . 6.0800000000000001 109.96 173.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.41 -29.78 66.49 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.471 1.108 . . . . 1.6899999999999999 113.852 174.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -56.58 -52.56 64.37 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.021 1.282 . . . . 1.24 109.494 169.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -65.11 -48.95 71.83 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 119.238 -0.411 . . . . 4.71 111.629 -176.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -56.52 -51.35 68.86 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.218 0.607 . . . . 4.0199999999999996 111.767 179.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 15.1 t -71.21 -41.08 70.69 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 113.315 0.857 . . . . 2.3900000000000001 113.315 -176.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -28.47 62.78 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.929 -1.107 . . . . 4.04 112.81 179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 tmm_? -75.9 -39.83 55.59 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 118.206 -0.902 . . . . 6.46 112.148 170.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -58.96 -41.03 86.52 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 119.579 1.081 . . . . 1.29 111.646 171.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.05 -47.69 83.6 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.407 1.083 . . . . 4.3499999999999996 111.756 170.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.94 -32.14 62.07 Favored Glycine 0 CA--C 1.538 1.483 0 O-C-N 121.493 -0.754 . . . . 2.5499999999999998 114.037 174.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -81.58 -28.53 33.76 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.639 1.576 . . . . 3.9199999999999999 113.403 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -87.23 -19.13 28.78 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 127.576 2.351 . . . . 4.0599999999999996 115.327 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 66.4 mt . . . . . 0 C--O 1.253 1.274 0 C-N-CA 124.51 1.124 . . . . 5.2599999999999998 110.18 165.306 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 118.46 -0.781 . . . . 6.1500000000000004 111.411 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.413 ' HA3' ' CD1' ' A' ' 32' ' ' TYR . . . 57.61 21.09 41.38 Favored Glycine 0 CA--C 1.544 1.888 0 C-N-CA 126.017 1.77 . . . . 3.3500000000000001 116.775 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -90.98 -19.37 23.31 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.694 2.109 . . . . 3.46 116.694 -161.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.0 mp 65.66 -51.93 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 128.102 2.561 . . . . 2.3199999999999998 114.473 -169.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 64.2 68.83 0.54 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 126.123 1.769 . . . . 4.25 112.638 -165.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.541 ' CE2' ' HD2' ' A' ' 24' ' ' LYS . 62.7 m95 -50.98 -34.06 27.38 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 127.687 2.395 . . . . 2.1400000000000001 116.904 -161.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -86.24 4.78 37.29 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.309 1.444 . . . . 3.3100000000000001 113.426 -176.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 70.9 m -86.93 -71.43 0.09 OUTLIER Pre-proline 0 CA--C 1.542 0.665 0 CA-C-O 117.197 -1.382 . . . . 6.46 112.319 173.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -73.38 177.15 8.28 Favored 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 122.639 2.226 . . . . 7.4000000000000004 110.942 169.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.7 p -74.61 31.19 0.09 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.533 1.679 . . . . 3.1000000000000001 115.533 178.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mp -70.98 -16.97 62.67 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 120.479 -1.388 . . . . 1.73 114.301 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -52.59 -40.63 55.55 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.655 1.121 . . . . 1.4099999999999999 113.649 -179.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.43 -22.93 57.37 Favored Glycine 0 CA--C 1.54 1.625 0 CA-C-N 118.513 1.157 . . . . 1.6399999999999999 114.838 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.91 -31.46 11.82 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.147 1.379 . . . . 2.02 113.22 172.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.414 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -102.1 -13.06 17.65 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 115.095 1.517 . . . . 0.79000000000000004 115.095 -167.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 54.5 m -92.08 161.77 14.63 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.729 1.612 . . . . 1.24 111.129 160.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 119.43 167.37 13.65 Favored Glycine 0 CA--C 1.54 1.63 0 C-N-CA 125.315 1.436 . . . . 0.71999999999999997 112.456 -177.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -41.85 -44.99 6.91 Favored 'Trans proline' 0 C--N 1.349 0.564 1 C-N-CA 125.317 4.011 . . . . 0.95999999999999996 113.109 169.029 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -102.94 14.35 32.16 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.086 1.354 . . . . 0.56000000000000005 113.226 -177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -58.58 -40.22 94.31 Favored Glycine 0 C--N 1.338 0.641 0 N-CA-C 111.159 -0.776 . . . . 0.51000000000000001 111.159 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.19 -27.88 67.51 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.141 1.377 . . . . 2.8199999999999998 113.925 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -68.55 -34.63 76.17 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.6 0.636 . . . . 0.68000000000000005 110.397 172.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.414 ' HD2' ' HB2' ' A' ' 15' ' ' ALA . 5.8 t80 -69.49 -41.09 76.58 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.854 0.687 . . . . 1.79 112.854 169.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HD2' ' CE2' ' A' ' 6' ' ' TRP . 31.7 mmtp -55.53 -50.0 71.15 Favored 'General case' 0 N--CA 1.47 0.525 0 CA-C-N 118.227 0.467 . . . . 0.84999999999999998 110.01 175.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.9 t -62.3 -45.84 91.45 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.091 1.756 . . . . 0.56000000000000005 112.526 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.33 -52.2 29.62 Favored 'General case' 0 CA--C 1.537 0.478 0 O-C-N 120.4 -1.438 . . . . 0.33000000000000002 113.705 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.39 -36.16 63.51 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.241 -0.885 . . . . 2.02 112.009 -177.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.7 t -64.74 -46.91 80.2 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.176 1.353 . . . . 1.8700000000000001 110.967 169.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 36.1 t -53.54 -44.53 69.27 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 121.128 1.786 . . . . 0.41999999999999998 111.286 175.089 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.436 ' CZ ' ' HE2' ' A' ' 38' ' ' LYS . 46.1 t80 -64.18 -42.41 96.69 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.584 0.957 . . . . 2.7000000000000002 113.584 174.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 16.7 m-70 -70.81 -22.21 62.37 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 120.684 -1.26 . . . . 3.0600000000000001 113.086 177.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.413 ' CD1' ' HA3' ' A' ' 2' ' ' GLY . 30.5 m-85 -81.05 -3.84 53.2 Favored 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 126.473 1.909 . . . . 2.4399999999999999 113.339 162.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 39.2 t -104.74 -59.22 1.77 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 126.067 1.747 . . . . 0.60999999999999999 112.606 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.1 p 43.99 49.36 7.31 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 126.642 1.977 . . . . 1.0900000000000001 113.759 -173.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -47.1 77.45 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.658 1.183 . . . . 4.2599999999999998 113.003 -173.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 160.41 -43.47 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 131.41 3.884 . . . . 3.6699999999999999 107.08 -174.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.9 mm -122.87 147.72 26.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.549 0 C-N-CA 128.779 2.831 . . . . 3.6299999999999999 109.452 -169.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HE2' ' CZ ' ' A' ' 30' ' ' PHE . 7.4 mmpt? -53.78 123.81 13.43 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.993 -0.442 . . . . 2.8199999999999998 111.021 171.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.22 -2.72 55.75 Favored Glycine 0 CA--C 1.535 1.309 0 N-CA-C 117.781 1.872 . . . . 1.3899999999999999 117.781 163.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 m -47.33 -32.36 4.73 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 121.031 2.415 . . . . 2.4500000000000002 115.829 176.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -123.2 30.26 6.4 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.589 1.156 . . . . 2.4700000000000002 111.65 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 33.6 m -151.63 13.65 0.64 Allowed 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 127.763 2.425 . . . . 0.54000000000000004 113.653 -176.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.4 p -64.66 -24.11 34.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 O-C-N 120.516 -1.365 . . . . 1.5 113.485 -163.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -63.01 -26.89 69.07 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 120.707 -1.246 . . . . 1.8999999999999999 113.319 174.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -75.15 -36.81 61.53 Favored 'General case' 0 CA--C 1.54 0.571 0 O-C-N 120.801 -1.187 . . . . 0.76000000000000001 111.73 174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -66.95 -38.12 85.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.904 0.882 . . . . 2.02 111.039 170.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -58.8 -46.11 88.32 Favored 'General case' 0 C--N 1.34 0.183 0 C-N-CA 124.345 1.058 . . . . 3.73 111.341 173.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.22 -38.28 90.5 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 124.484 1.115 . . . . 0.55000000000000004 113.002 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.0 ttt -57.49 -52.83 63.79 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.107 0.563 . . . . 2.4399999999999999 111.009 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -64.35 -46.77 82.0 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 118.478 0.581 . . . . 3.1600000000000001 111.762 176.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -56.78 -27.66 60.03 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 126.849 2.06 . . . . 2.5499999999999998 115.326 178.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.9 t -88.39 -43.75 11.27 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.25 1.02 . . . . 0.66000000000000003 111.324 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 65.8 mtt -79.58 -17.82 53.06 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.359 -1.463 . . . . 2.2999999999999998 111.933 -168.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -61.51 -21.75 64.51 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.889 1.676 . . . . 1.55 113.352 167.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 8.7 mmmm -62.33 -38.24 88.7 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.168 1.387 . . . . 2.4100000000000001 112.852 174.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.605 ' HB3' HD12 ' A' ' 59' ' ' LEU . 11.2 m-85 -133.01 131.62 21.99 Favored Pre-proline 0 CA--C 1.541 0.613 0 N-CA-C 113.111 0.782 . . . . 2.1800000000000002 113.111 -165.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.89 -48.47 0.15 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.778 2.319 . . . . 2.3500000000000001 113.292 -177.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -156.02 9.08 0.25 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.323 1.849 . . . . 4.0300000000000002 111.787 -165.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -79.89 -14.04 58.94 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 119.466 -2.021 . . . . 1.8300000000000001 115.435 -141.558 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.412 ' CD2' ' CD1' ' A' ' 59' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.105 0 C-N-CA 126.175 1.79 . . . . 3.1699999999999999 113.416 -160.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 110.195 -0.298 . . . . 10.77 110.195 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 56.4 m80 -81.55 -21.5 38.45 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 115.753 1.76 . . . . 10.16 115.753 -172.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 43.5 t -73.46 135.1 44.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.897 0.771 . . . . 4.4100000000000001 112.273 -178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 173.9 -2.27 0.03 OUTLIER Glycine 0 CA--C 1.54 1.599 0 N-CA-C 116.178 1.231 . . . . 3.4700000000000002 116.178 177.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 20.2 m-70 -66.44 -32.37 73.71 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.722 1.761 . . . . 5.2999999999999998 114.201 -174.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 10.9 mt -76.83 -34.16 57.91 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.34 0.973 . . . . 2.8399999999999999 110.872 173.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 35.9 mm -59.04 -41.75 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.128 0 CA-C-N 119.971 1.26 . . . . 2.9399999999999999 111.662 178.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -52.15 -48.47 64.89 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.348 1.059 . . . . 4.1399999999999997 110.912 172.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.87 -34.8 71.97 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.976 1.311 . . . . 1.3500000000000001 113.391 177.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -56.72 -55.76 30.07 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 119.19 0.905 . . . . 1.1899999999999999 109.126 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -75.22 -31.53 60.9 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.134 1.161 . . . . 4.54 114.134 -178.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -60.47 -54.29 47.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 119.215 0.916 . . . . 4.9400000000000004 111.291 173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 88.8 p -71.24 -43.98 66.24 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.584 0.754 . . . . 2.0 112.666 -178.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 17.5 tmm? -66.27 -38.13 87.08 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.778 -1.106 . . . . 3.3100000000000001 111.73 178.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 20.9 tpt180 -71.13 -32.73 69.34 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 120.507 1.503 . . . . 7.7699999999999996 113.062 172.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.09 -52.42 65.82 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 120.478 1.49 . . . . 1.0600000000000001 111.927 171.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.55 -46.09 89.91 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.54 -0.725 . . . . 3.3300000000000001 110.621 174.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.78 -35.74 87.46 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.887 1.232 . . . . 1.8700000000000001 114.576 178.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -76.49 -34.88 58.63 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.596 1.198 . . . . 3.7000000000000002 112.394 174.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -69.65 -29.55 67.04 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 113.491 0.922 . . . . 4.6500000000000004 113.491 173.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 C--O 1.254 1.297 0 CA-C-O 116.699 -1.619 . . . . 3.6200000000000001 112.757 177.979 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 112.779 0.659 . . . . 4.4900000000000002 112.779 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.56 -42.22 0.42 Allowed Glycine 0 CA--C 1.541 1.694 0 C-N-CA 126.473 1.987 . . . . 2.4399999999999999 113.857 -169.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -25.88 147.27 0.0 OUTLIER 'General case' 0 C--O 1.236 0.361 1 C-N-CA 131.94 4.096 . . . . 4.8799999999999999 116.396 168.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.431 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.6 mp -91.6 -47.47 14.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 113.779 -1.555 . . . . 2.5600000000000001 111.815 170.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 68.66 98.44 0.06 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.408 1.883 . . . . 2.0899999999999999 112.56 -161.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.534 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 34.4 m95 -80.2 1.88 26.53 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 125.761 1.624 . . . . 1.3500000000000001 113.204 -172.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -70.89 -23.87 62.37 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.998 1.719 . . . . 3.1699999999999999 113.301 175.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.415 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.7 m -67.84 123.52 87.24 Favored Pre-proline 0 CA--C 1.548 0.883 0 CA-C-O 118.312 -0.851 . . . . 5.0300000000000002 109.947 178.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 8' ' ' SER . 85.6 Cg_exo -62.32 -34.91 76.16 Favored 'Trans proline' 0 C--N 1.355 0.917 0 N-CA-C 117.76 2.177 . . . . 4.3899999999999997 117.76 -156.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -77.28 -55.69 5.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.544 0.737 . . . . 4.2400000000000002 112.095 -173.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.7 tt -62.62 -41.63 99.12 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.839 1.655 . . . . 1.95 109.905 171.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -55.4 -35.88 62.12 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.472 1.034 . . . . 1.53 113.843 174.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.9 -36.63 91.34 Favored Glycine 0 CA--C 1.535 1.316 0 CA-C-N 118.438 1.119 . . . . 1.28 113.215 173.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 65.4 mmm -69.81 -41.31 75.19 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.057 0.928 . . . . 2.2599999999999998 111.044 172.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -80.07 23.68 0.45 Allowed 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 126.934 2.093 . . . . 1.3600000000000001 113.966 173.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 66.4 m -127.07 167.35 16.07 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 126.835 2.054 . . . . 1.3600000000000001 108.864 170.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.93 -179.54 42.74 Favored Glycine 0 CA--C 1.542 1.77 0 N-CA-C 115.675 1.03 . . . . 1.1499999999999999 115.675 177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HG2' HD11 ' A' ' 59' ' ' LEU . 50.3 Cg_exo -52.89 -30.98 50.22 Favored 'Trans proline' 0 C--N 1.347 0.473 1 C-N-CA 127.376 5.384 . . . . 1.49 115.635 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 59.4 m -111.65 10.2 21.06 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.986 1.314 . . . . 1.1599999999999999 112.893 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -41.87 -49.62 5.14 Favored Glycine 0 N--CA 1.468 0.789 0 C-N-CA 124.607 1.098 . . . . 0.95999999999999996 113.81 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -66.55 -26.7 67.26 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 118.827 1.313 . . . . 3.3900000000000001 114.398 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -68.65 -31.99 71.52 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.311 0.959 . . . . 1.1499999999999999 109.805 171.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -70.19 -45.66 66.18 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 118.431 0.56 . . . . 1.5700000000000001 111.972 170.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.534 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.6 mmtp -54.29 -47.76 72.01 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.603 0.761 . . . . 0.59999999999999998 110.332 176.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 35.9 t -75.87 -41.22 52.87 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.849 1.66 . . . . 0.46999999999999997 112.88 -174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.66 79.1 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 120.889 -1.132 . . . . 0.34999999999999998 112.543 172.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -79.14 -33.73 43.93 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-O 117.995 -1.003 . . . . 2.1800000000000002 113.276 -174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.9 p -64.26 -47.09 80.9 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 120.047 1.294 . . . . 1.3799999999999999 110.781 167.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.0 t -53.98 -44.99 71.28 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 119.485 1.039 . . . . 0.47999999999999998 110.905 174.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -65.6 -40.63 92.9 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.88 1.067 . . . . 3.5600000000000001 113.88 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 69.7 m80 -72.76 -21.73 60.96 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 120.976 1.716 . . . . 3.6299999999999999 113.601 -179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -79.34 -19.27 50.68 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.178 -0.951 . . . . 2.7799999999999998 113.21 163.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.3 t -82.15 -64.24 1.22 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.988 1.715 . . . . 0.77000000000000002 112.527 176.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 40.0 p 49.68 32.49 5.16 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.549 1.94 . . . . 1.25 113.775 -175.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -69.1 -65.06 0.75 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.082 0.953 . . . . 2.8300000000000001 113.131 -164.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -166.53 -48.1 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.351 1.461 . . . . 3.5 109.945 173.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 38.7 mm -112.14 148.69 15.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.672 1.989 . . . . 2.6699999999999999 109.252 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.74 122.97 13.37 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-N 119.107 0.867 . . . . 2.4700000000000002 110.244 174.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.36 3.29 76.69 Favored Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.076 -1.402 . . . . 1.25 116.293 168.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 81.7 p -55.85 -19.12 10.53 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.841 2.163 . . . . 1.51 116.841 -177.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -131.88 26.53 4.63 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 126.134 1.773 . . . . 2.48 111.305 175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.3 m -149.88 9.07 0.68 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.571 2.349 . . . . 0.40999999999999998 113.627 -172.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.6 p -64.02 -25.26 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 114.126 1.158 . . . . 1.47 114.126 -162.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -62.58 -24.36 67.51 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 120.256 1.389 . . . . 2.0800000000000001 113.134 176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.89 -39.0 64.2 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 120.675 -1.266 . . . . 0.67000000000000004 111.726 174.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -68.41 -35.2 77.3 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 120.805 -1.184 . . . . 1.77 110.809 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -60.84 -42.9 98.68 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 125.637 1.575 . . . . 3.52 112.105 171.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.65 85.06 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.705 0.802 . . . . 0.53000000000000003 112.444 171.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 ttp -61.73 -47.93 83.02 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.674 -0.641 . . . . 2.3799999999999999 111.648 176.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.2 -47.25 83.35 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 121.586 -0.696 . . . . 3.2200000000000002 112.1 172.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -56.95 -23.75 47.86 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.919 2.088 . . . . 2.9100000000000001 115.171 175.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.7 t -87.2 -44.22 11.64 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.689 1.196 . . . . 1.05 111.641 169.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.3 mtm -74.8 -18.84 60.4 Favored 'General case' 0 N--CA 1.471 0.596 0 O-C-N 120.914 -1.116 . . . . 4.5 111.839 -169.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.4 pp0? -73.42 -27.25 61.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.469 1.908 . . . . 1.3700000000000001 113.289 175.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.431 ' HE3' ' CZ ' ' A' ' 56' ' ' TYR . 26.6 mtmt -67.48 -31.94 72.42 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.479 1.659 . . . . 2.7999999999999998 115.479 -171.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.431 ' CZ ' ' HE3' ' A' ' 55' ' ' LYS . 8.0 m-85 -118.71 126.56 27.07 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 123.025 0.53 . . . . 2.9199999999999999 112.013 -161.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -86.38 -21.82 2.28 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.082 2.521 . . . . 5.0099999999999998 113.815 175.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -165.08 -2.22 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.046 1.498 . . . . 8.3599999999999994 115.046 -150.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.428 HD11 ' HG2' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -82.76 -8.71 59.57 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 124.737 1.215 . . . . 3.8599999999999999 113.22 -161.098 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 C--O 1.251 1.175 0 C-N-CA 127.553 2.341 . . . . 4.5199999999999996 113.817 -163.84 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.539 -0.171 . . . . 13.18 110.539 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -62.68 144.15 56.63 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.922 0.889 . . . . 10.039999999999999 112.503 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 48.5 t -83.18 -51.83 7.14 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.926 0.891 . . . . 4.7199999999999998 110.544 167.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 160.01 143.78 3.77 Favored Glycine 0 CA--C 1.534 1.241 0 C-N-CA 124.469 1.033 . . . . 4.04 114.516 171.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 53.3 t60 -67.14 -35.38 79.59 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.728 1.211 . . . . 5.8899999999999997 113.111 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 72.3 mt -88.42 -10.31 49.63 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.285 1.587 . . . . 4.6600000000000001 115.285 -163.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.21 -45.29 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 120.688 1.586 . . . . 2.5499999999999998 114.622 -164.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -69.35 -25.6 64.27 Favored 'General case' 0 N--CA 1.472 0.637 0 O-C-N 120.447 -1.408 . . . . 4.2599999999999998 112.388 177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -81.81 -28.53 33.08 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.387 1.475 . . . . 1.3600000000000001 112.722 174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -62.05 -52.96 61.84 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.218 0.917 . . . . 1.6899999999999999 109.466 166.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -64.15 -43.89 93.81 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.348 0.659 . . . . 4.5300000000000002 112.253 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -61.35 -48.63 80.42 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.005 0.522 . . . . 4.3700000000000001 111.62 174.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -64.0 -46.82 82.82 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 118.872 0.76 . . . . 1.9199999999999999 112.376 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 13.6 ptt? -67.35 -33.54 75.45 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.897 0.771 . . . . 3.3999999999999999 112.209 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.64 68.25 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 119.045 0.839 . . . . 5.4100000000000001 111.028 171.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -63.52 -46.19 87.15 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.242 0.928 . . . . 0.96999999999999997 112.691 -178.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.4 mt -65.55 -48.74 71.4 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.48 1.112 . . . . 3.8599999999999999 110.85 174.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.01 -39.16 91.52 Favored Glycine 0 CA--C 1.532 1.138 0 C-N-CA 123.496 0.569 . . . . 1.9299999999999999 113.006 177.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -66.14 -40.32 90.53 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.258 1.423 . . . . 3.4300000000000002 112.844 172.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -73.15 -40.97 64.44 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.438 1.644 . . . . 3.1499999999999999 115.438 -177.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 17.2 pt . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 115.869 1.803 . . . . 4.0599999999999996 115.869 -170.518 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 . . . . . 0 N--CA 1.473 0.709 0 CA-C-O 117.601 -1.19 . . . . 4.75 109.608 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 60.69 19.64 55.23 Favored Glycine 0 CA--C 1.537 1.409 0 CA-C-N 120.13 1.332 . . . . 2.6899999999999999 113.832 -177.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -118.33 159.18 23.85 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.302 1.841 . . . . 3.23 112.284 -157.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' CE3' ' A' ' 6' ' ' TRP . 2.8 mp -73.63 164.63 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 127.613 2.365 . . . . 2.5499999999999998 111.105 177.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 61.2 t-20 -97.6 118.22 33.63 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 120.51 -1.368 . . . . 3.46 111.547 151.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.607 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 46.5 m95 -102.07 -5.89 23.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.156 1.539 . . . . 2.5899999999999999 115.156 -163.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -95.19 -47.91 6.15 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 115.389 1.626 . . . . 4.5099999999999998 115.389 -151.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 16.3 t -153.34 -56.86 0.02 OUTLIER Pre-proline 0 N--CA 1.47 0.575 0 C-N-CA 125.357 1.463 . . . . 6.5599999999999996 109.774 -173.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -63.33 169.44 9.5 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.046 1.83 . . . . 5.5099999999999998 111.714 159.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.6 m 48.55 -101.58 0.08 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.646 1.578 . . . . 6.6600000000000001 113.616 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.539 HD23 ' CE2' ' A' ' 23' ' ' PHE . 8.7 mp -93.43 8.42 40.64 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.378 1.471 . . . . 1.8799999999999999 114.06 -171.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -39.48 -60.51 1.7 Allowed Glycine 0 N--CA 1.475 1.234 0 C-N-CA 126.656 2.075 . . . . 2.3199999999999998 115.957 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.44 -17.77 57.35 Favored Glycine 0 CA--C 1.535 1.32 0 N-CA-C 115.41 0.924 . . . . 2.8999999999999999 115.41 -179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.408 ' HG2' ' CZ ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -105.14 -42.47 5.28 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 119.25 1.525 . . . . 2.48 114.782 -175.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -87.12 37.05 0.75 Allowed 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 114.128 1.159 . . . . 1.1699999999999999 114.128 -163.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.4 m -141.58 153.93 45.12 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 125.377 1.471 . . . . 1.8200000000000001 112.843 172.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.77 -177.45 19.26 Favored Glycine 0 CA--C 1.54 1.605 0 C-N-CA 125.108 1.337 . . . . 1.3500000000000001 113.721 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -46.37 -23.25 1.98 Allowed 'Trans proline' 0 C--N 1.351 0.704 1 C-N-CA 126.566 4.844 . . . . 1.6000000000000001 116.236 165.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 28.0 m -129.34 19.62 5.8 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.582 1.553 . . . . 0.96999999999999997 111.825 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -51.77 -45.99 54.77 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.565 -1.014 . . . . 0.63 110.565 -175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -59.27 -29.21 67.41 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 126.229 1.812 . . . . 2.79 114.01 177.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -70.68 -33.45 70.94 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.546 -0.721 . . . . 1.02 110.577 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.539 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.3 t80 -67.71 -41.79 82.99 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 118.528 0.603 . . . . 2.1400000000000001 112.357 168.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.607 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.9 mmtp -53.56 -52.03 61.05 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 121.48 0.657 . . . . 0.89000000000000001 111.068 174.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.3 t -63.81 -44.07 94.4 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.612 1.965 . . . . 0.60999999999999999 112.573 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.59 -51.04 55.15 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.063 -1.023 . . . . 0.39000000000000001 113.2 178.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.407 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -76.26 -28.35 57.05 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 118.295 -0.859 . . . . 2.1099999999999999 113.151 -178.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 t -61.6 -54.24 45.58 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 119.65 1.114 . . . . 1.74 110.238 164.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.2 t -52.84 -41.4 64.22 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 119.078 0.854 . . . . 0.51000000000000001 111.371 177.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -65.72 -42.05 91.54 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.068 1.136 . . . . 2.4100000000000001 114.068 172.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -61.15 -37.83 84.25 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.482 1.492 . . . . 2.79 112.541 175.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -72.28 -17.6 61.86 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.69 0.796 . . . . 2.5499999999999998 112.855 170.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.4 t -91.25 -65.45 1.01 Allowed 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.29 1.836 . . . . 0.93000000000000005 113.849 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 24.8 p 50.55 36.87 14.66 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 126.202 1.801 . . . . 1.45 114.37 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -78.62 -69.41 0.56 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 125.589 1.556 . . . . 2.9500000000000002 114.945 -169.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -159.91 -53.23 0.06 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.317 1.447 . . . . 3.0800000000000001 110.002 -171.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.2 mt -124.64 148.9 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.373 1.469 . . . . 1.6200000000000001 110.447 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 32.4 mmtm -56.34 99.76 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.013 0.925 . . . . 1.6799999999999999 110.115 171.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 102.23 0.07 50.8 Favored Glycine 0 CA--C 1.53 0.988 0 CA-C-O 117.132 -1.927 . . . . 1.4399999999999999 116.178 -177.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 66.8 p -60.9 -14.24 21.02 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 121.861 2.83 . . . . 1.6799999999999999 115.709 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -128.97 22.75 5.73 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 114.317 1.228 . . . . 2.1099999999999999 114.317 160.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 56.0 m -144.73 7.32 1.25 Allowed 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.32 1.448 . . . . 0.53000000000000003 114.184 -169.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 7.2 p -57.43 -27.52 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.878 1.271 . . . . 1.48 113.389 -168.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.02 -30.69 69.33 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 119.743 1.156 . . . . 2.3300000000000001 113.487 175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -74.5 -35.8 63.22 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.903 0.881 . . . . 0.64000000000000001 112.115 175.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -70.89 -37.19 73.0 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.839 -1.163 . . . . 1.8400000000000001 110.867 172.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 42.2 ttt85 -62.0 -41.79 98.44 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 118.377 -0.821 . . . . 4.1500000000000004 111.157 171.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.55 92.64 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.917 0.887 . . . . 0.95999999999999996 112.518 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.3 ttp -57.21 -48.68 78.18 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.654 -0.654 . . . . 3.52 111.445 174.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 59.6 tp60 -70.55 -45.08 66.15 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 113.367 0.877 . . . . 3.6899999999999999 113.367 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -53.31 -25.43 14.8 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 127.834 2.454 . . . . 2.5099999999999998 114.077 170.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.5 t -90.64 -41.15 11.49 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.028 0.931 . . . . 1.27 111.911 170.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 50.2 mtt -74.91 -21.73 59.04 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 119.703 -1.873 . . . . 1.99 111.923 -169.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -56.74 -17.73 10.06 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.503 1.921 . . . . 2.3100000000000001 113.519 167.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -68.92 -29.82 68.17 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.763 1.625 . . . . 3.3500000000000001 114.48 172.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -145.41 125.36 7.07 Favored Pre-proline 0 N--CA 1.471 0.603 0 CA-C-N 118.889 0.768 . . . . 2.8300000000000001 112.874 -170.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -88.73 -30.91 0.19 Allowed 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 122.288 1.992 . . . . 2.7200000000000002 115.95 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -161.5 59.96 0.27 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 122.527 1.156 . . . . 4.5199999999999996 113.369 -163.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.281 0.7 OUTLIER -137.51 -10.44 1.64 Allowed 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 114.353 -1.294 . . . . 2.0099999999999998 111.922 -156.732 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.3 p90 . . . . . 0 C--O 1.256 1.407 0 C-N-CA 126.709 2.004 . . . . 2.9700000000000002 112.704 -166.631 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 111.261 0.097 . . . . 19.09 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -129.16 145.65 51.27 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.341 1.457 . . . . 14.33 113.657 -173.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.9 t -57.09 -34.94 68.82 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.591 1.556 . . . . 8.7799999999999994 113.996 -176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.53 -20.29 78.32 Favored Glycine 0 CA--C 1.538 1.495 0 N-CA-C 115.681 1.032 . . . . 4.8899999999999997 115.681 176.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -121.8 -25.11 5.1 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 114.956 1.465 . . . . 5.71 114.956 -170.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 4.5 pp -55.86 -22.01 22.95 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 119.751 1.16 . . . . 3.5899999999999999 113.968 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 11.8 tt -65.71 -39.5 85.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.242 1.417 . . . . 3.1099999999999999 112.999 173.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 -69.29 -41.04 77.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 119.732 1.151 . . . . 4.3200000000000003 111.319 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.35 75.52 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 122.984 0.514 . . . . 1.6799999999999999 111.704 176.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -70.64 -28.4 64.78 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.271 -0.893 . . . . 2.77 113.026 178.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -68.04 -46.78 70.18 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.642 1.177 . . . . 5.2199999999999998 111.435 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -65.2 -36.86 85.51 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.01 0.823 . . . . 5.0300000000000002 112.73 171.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.3 m -67.75 -39.68 84.16 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 119.304 0.956 . . . . 2.25 113.471 177.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.42 -33.57 54.92 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 119.057 0.844 . . . . 3.3700000000000001 112.356 177.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.17 -37.62 87.95 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 118.198 -0.906 . . . . 9.2599999999999998 111.117 169.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.12 -38.87 86.34 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.148 0.979 . . . . 1.9299999999999999 113.306 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 10.5 tt -63.64 -44.26 94.37 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 121.229 -0.919 . . . . 3.7999999999999998 111.563 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.3 -32.0 71.92 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.306 0.955 . . . . 2.77 113.778 174.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 85.0 t80 -70.13 -37.59 75.34 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.384 1.473 . . . . 4.79 112.993 173.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -72.03 -43.92 64.22 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.344 1.058 . . . . 5.0099999999999998 112.974 173.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.381 11.1 tp . . . . . 0 N--CA 1.481 1.116 0 C-N-CA 129.25 3.02 . . . . 5.8300000000000001 114.903 -170.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 118.661 -0.685 . . . . 3.8399999999999999 110.535 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 56.54 24.43 46.84 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 119.31 0.959 . . . . 2.1000000000000001 115.056 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -69.69 156.64 38.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.839 1.319 . . . . 3.1000000000000001 113.502 -178.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.531 HG21 ' CE3' ' A' ' 6' ' ' TRP . 1.2 mp -81.31 -43.82 20.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 125.879 1.672 . . . . 2.25 112.586 177.306 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 67.39 80.91 0.2 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 127.442 2.297 . . . . 2.1099999999999999 112.742 -160.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.554 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 62.9 m95 -67.9 -11.0 57.84 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.9 1.28 . . . . 1.3400000000000001 114.391 -171.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -64.59 -22.22 66.91 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.619 1.168 . . . . 2.3100000000000001 112.442 168.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 79.8 p -70.44 120.03 76.03 Favored Pre-proline 0 CA--C 1.546 0.791 0 O-C-N 121.353 -0.842 . . . . 5.0300000000000002 110.767 174.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.42 -17.2 44.05 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 4.1900000000000004 114.675 -160.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 m -70.69 -27.5 64.05 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 121.266 -0.896 . . . . 3.1099999999999999 112.603 -179.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mp -98.15 -24.25 15.37 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.604 1.093 . . . . 1.26 112.341 159.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.75 -31.29 53.75 Favored Glycine 0 CA--C 1.533 1.215 0 CA-C-N 119.351 0.978 . . . . 1.1399999999999999 114.847 -171.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.65 -53.46 27.82 Favored Glycine 0 CA--C 1.534 1.243 0 CA-C-N 119.016 1.408 . . . . 1.4099999999999999 112.43 170.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.466 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 39.2 tpp -71.23 -30.14 65.99 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.076 1.351 . . . . 2.3900000000000001 114.323 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.447 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -84.6 -10.87 56.98 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.718 1.607 . . . . 0.93000000000000005 113.445 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.0 m -87.35 173.84 8.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.86 1.264 . . . . 1.0800000000000001 111.151 163.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 97.02 167.7 33.19 Favored Glycine 0 CA--C 1.543 1.834 0 O-C-N 120.834 -1.166 . . . . 0.69999999999999996 114.65 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -44.75 -36.57 10.73 Favored 'Trans proline' 0 CA--C 1.54 0.814 1 C-N-CA 126.511 4.807 . . . . 1.03 114.878 169.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 63.1 m -102.3 16.11 27.17 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.381 1.252 . . . . 0.55000000000000004 114.381 -177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.58 -55.74 4.46 Favored Glycine 0 C--N 1.341 0.827 0 C-N-CA 124.844 1.211 . . . . 0.68999999999999995 113.558 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -61.71 -22.61 65.5 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 114.061 1.134 . . . . 3.8300000000000001 114.061 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -70.25 -37.97 75.06 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.312 0.96 . . . . 0.69999999999999996 110.449 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.466 ' CE2' ' HB3' ' A' ' 14' ' ' MET . 6.5 t80 -69.59 -41.03 76.33 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.468 0.544 . . . . 1.6100000000000001 112.468 171.016 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 33.3 mmtp -58.18 -51.74 68.48 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 122.041 0.924 . . . . 0.67000000000000004 110.351 179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -70.54 -38.09 74.16 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.259 1.424 . . . . 0.70999999999999996 111.891 -178.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.05 -53.67 46.23 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.987 1.267 . . . . 0.32000000000000001 113.28 174.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.26 -29.6 53.99 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.346 0.869 . . . . 2.1000000000000001 113.346 -175.077 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.7 p -65.28 -47.98 74.78 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.618 1.099 . . . . 1.3200000000000001 111.412 166.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.6 t -54.83 -39.59 68.71 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 119.774 1.17 . . . . 0.40999999999999998 110.942 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -68.0 -41.52 82.15 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.256 1.206 . . . . 2.7000000000000002 114.256 172.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -63.1 -25.29 68.29 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 120.018 1.281 . . . . 2.7200000000000002 113.357 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -91.3 -10.24 42.12 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.115 1.366 . . . . 2.25 114.105 169.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.3 t -93.83 -61.52 1.52 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.136 1.774 . . . . 0.66000000000000003 111.798 -179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 74.3 p 53.41 34.04 17.25 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.822 1.649 . . . . 1.1299999999999999 114.324 178.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -73.81 -72.74 0.25 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.728 1.381 . . . . 2.5299999999999998 114.728 -170.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -162.5 -48.71 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.129 0.971 . . . . 2.9399999999999999 111.942 -164.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 18.0 mt -130.33 153.29 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 125.419 1.488 . . . . 2.1499999999999999 109.424 175.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -50.91 100.84 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.657 1.183 . . . . 1.76 110.637 172.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.93 11.41 81.46 Favored Glycine 0 CA--C 1.53 1.017 0 CA-C-O 117.275 -1.847 . . . . 1.29 116.69 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.6 p -51.33 -22.3 2.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 120.997 2.398 . . . . 1.51 115.402 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -132.03 19.33 4.53 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 125.184 1.394 . . . . 2.7599999999999998 112.527 173.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 28.0 m -135.79 17.86 3.29 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.039 2.136 . . . . 0.64000000000000001 112.234 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -56.37 -29.73 29.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 126.311 1.844 . . . . 1.3500000000000001 113.585 -167.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.14 -29.36 69.74 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 120.599 1.545 . . . . 1.8200000000000001 112.974 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -73.1 -40.24 65.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.078 0.951 . . . . 0.57999999999999996 112.152 174.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -70.18 -34.58 73.15 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.231 -0.918 . . . . 1.6899999999999999 110.875 174.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.0 -41.84 97.37 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-O 118.196 -0.906 . . . . 3.9100000000000001 111.39 169.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.412 ' HA ' ' HB3' ' A' ' 51' ' ' GLU . . . -63.72 -34.66 78.37 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.957 0.799 . . . . 0.56000000000000005 112.231 172.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 44.9 ttp -61.25 -45.0 96.33 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.386 -0.821 . . . . 2.5899999999999999 111.819 172.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.1 tm0? -63.66 -51.41 65.25 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 119.273 0.942 . . . . 4.25 111.739 173.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB3' ' HA ' ' A' ' 48' ' ' ALA . 13.6 tt0 -58.06 -19.72 33.87 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.861 2.865 . . . . 2.71 114.622 176.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 44.1 t -95.43 -45.76 6.97 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.023 1.329 . . . . 0.70999999999999996 112.899 168.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 61.2 mtt -78.32 -15.71 58.45 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 119.981 -1.699 . . . . 2.0499999999999998 112.229 -168.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -52.8 -23.47 6.97 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.445 1.898 . . . . 1.79 113.377 164.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 58.7 mtpt -68.78 -42.15 77.78 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.787 1.235 . . . . 3.1899999999999999 113.063 175.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.583 ' HB3' HD12 ' A' ' 59' ' ' LEU . 16.9 m-85 -139.22 117.35 8.88 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.969 1.1 . . . . 2.1699999999999999 113.969 -163.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -81.67 -26.99 2.84 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.55 2.833 . . . . 2.3500000000000001 114.726 -168.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -157.34 1.79 0.12 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.47 1.508 . . . . 4.2599999999999998 113.927 -171.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.583 HD12 ' HB3' ' A' ' 56' ' ' TYR . 0.0 OUTLIER -81.34 -8.78 59.8 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 119.791 -1.818 . . . . 1.8799999999999999 114.456 -140.945 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.286 0 C-N-CA 127.388 2.275 . . . . 2.75 113.847 -165.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 81.4 mt-10 . . . . . 0 N--CA 1.479 0.976 0 N-CA-C 109.529 -0.545 . . . . 11.08 109.529 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 34.6 p80 -121.91 -22.29 5.78 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 125.353 1.461 . . . . 8.8699999999999992 113.476 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 12.4 m -55.08 138.35 44.4 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.359 0.981 . . . . 4.3899999999999997 111.161 175.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 178.89 -152.98 11.77 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 124.909 1.243 . . . . 3.3900000000000001 110.495 -170.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 49.4 t60 37.88 -85.98 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.097 2.559 . . . . 5.9800000000000004 115.109 174.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -53.08 -33.59 52.82 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 120.38 1.446 . . . . 2.5099999999999998 113.361 177.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.23 -35.72 64.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 119.217 0.917 . . . . 2.3599999999999999 111.915 178.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -67.94 -32.3 72.65 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.738 -1.226 . . . . 3.5 110.863 174.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -73.07 -37.27 66.86 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.889 0.876 . . . . 1.48 113.019 170.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -56.46 -53.16 60.68 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 119.731 1.15 . . . . 1.3700000000000001 109.754 170.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -56.25 -53.14 60.8 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.809 2.044 . . . . 4.5 112.039 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -69.95 -40.12 75.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 113.198 0.814 . . . . 3.5600000000000001 113.198 -176.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 24.3 m -69.72 -42.09 74.48 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.225 0.921 . . . . 1.6599999999999999 111.722 177.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.7 ptm -69.69 -29.86 67.38 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.496 1.044 . . . . 2.6099999999999999 112.525 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.04 -52.67 61.92 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 118.773 0.715 . . . . 5.2699999999999996 112.193 167.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.64 -38.74 88.79 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.572 0.749 . . . . 0.89000000000000001 112.436 -177.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.2 tt -72.42 -43.74 63.44 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.416 1.086 . . . . 3.29 111.892 177.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.09 -39.12 91.66 Favored Glycine 0 CA--C 1.535 1.309 0 CA-C-N 118.826 0.739 . . . . 1.7 113.152 172.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.2 t80 -67.11 -38.35 85.48 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.369 1.068 . . . . 3.5600000000000001 112.759 171.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -70.25 -31.16 68.42 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 117.336 -1.316 . . . . 3.5699999999999998 114.081 179.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 70.7 mt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.468 -1.253 . . . . 4.3899999999999997 112.374 176.446 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 118.979 -0.534 . . . . 4.1799999999999997 110.671 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.21 23.24 57.29 Favored Glycine 0 CA--C 1.536 1.397 0 CA-C-N 119.355 0.98 . . . . 2.2200000000000002 114.929 -176.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -72.2 150.07 44.06 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 119.161 1.481 . . . . 2.9700000000000002 114.007 -173.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.469 HG21 ' CZ3' ' A' ' 6' ' ' TRP . 1.1 mp -67.5 -43.19 87.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 125.89 1.676 . . . . 2.9500000000000002 112.803 179.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 76.28 94.17 0.07 Allowed 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 128.389 2.676 . . . . 2.46 113.737 -157.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.485 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 33.6 m95 -80.04 15.72 1.41 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.216 1.561 . . . . 1.49 115.216 -173.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -115.64 -12.33 11.59 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.157 1.383 . . . . 2.29 113.008 167.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 86.8 p -60.46 156.88 39.35 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.621 1.168 . . . . 5.3499999999999996 113.658 -176.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -52.84 131.3 41.44 Favored 'Trans proline' 0 C--N 1.354 0.833 0 C-N-CA 123.506 2.804 . . . . 5.5199999999999996 115.066 -165.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 56.4 m 60.45 -38.24 0.09 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.861 3.264 . . . . 5.1600000000000001 116.056 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.85 -35.19 72.53 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 125.041 1.337 . . . . 2.3399999999999999 110.553 168.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -51.24 -38.28 40.26 Favored Glycine 0 CA--C 1.535 1.313 0 C-N-CA 124.573 1.082 . . . . 1.6299999999999999 114.561 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.33 -34.68 60.64 Favored Glycine 0 CA--C 1.535 1.314 0 CA-C-N 118.973 1.386 . . . . 1.7 113.813 171.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 10.2 tpt -66.32 -34.61 78.38 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.984 1.314 . . . . 1.76 113.89 -173.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.501 ' HB1' ' CE ' ' A' ' 24' ' ' LYS 0.251 . . -89.86 8.1 33.82 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.814 1.413 . . . . 0.90000000000000002 114.814 -172.615 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.5 m -98.27 -177.32 3.68 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 126.646 1.978 . . . . 1.29 110.75 165.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.31 177.63 27.52 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.842 -1.161 . . . . 0.80000000000000004 114.922 175.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' HD2' ' CG ' ' A' ' 60' ' ' TYR . 31.8 Cg_endo -47.91 -30.28 13.27 Favored 'Trans proline' 0 C--N 1.349 0.601 1 C-N-CA 125.505 4.137 . . . . 1.3799999999999999 114.525 166.449 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.3 m -117.6 17.4 14.45 Favored 'General case' 0 C--O 1.233 0.214 0 C-N-CA 124.757 1.223 . . . . 0.81000000000000005 113.162 -172.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.66 -59.79 3.08 Favored Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.275 0.94 . . . . 0.60999999999999999 112.337 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -61.65 -24.51 66.78 Favored 'General case' 0 CA--C 1.514 -0.419 0 N-CA-C 114.712 1.375 . . . . 4.8099999999999996 114.712 179.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -69.12 -35.37 76.34 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 120.665 1.575 . . . . 0.81999999999999995 110.245 173.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -67.74 -44.05 78.46 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 120.527 -0.469 . . . . 1.95 112.097 170.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.501 ' CE ' ' HB1' ' A' ' 15' ' ' ALA . 32.5 mmtp -56.13 -51.81 66.59 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 121.381 0.61 . . . . 0.57999999999999996 110.943 177.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 48.2 t -64.26 -46.87 81.84 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 127.499 2.319 . . . . 0.48999999999999999 111.453 -177.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -67.27 -52.3 42.43 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.883 -1.135 . . . . 0.31 113.629 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -73.68 -31.4 63.43 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 118.533 -0.746 . . . . 1.97 112.51 -175.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 87.7 p -65.6 -47.51 75.44 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 119.629 1.104 . . . . 1.3500000000000001 111.971 167.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.9 t -58.76 -38.64 78.9 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 119.501 1.046 . . . . 0.40999999999999998 111.371 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.506 ' CE1' ' HE2' ' A' ' 38' ' ' LYS . 0.7 OUTLIER -56.68 -53.04 62.26 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.712 1.205 . . . . 2.6899999999999999 112.884 166.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.31 -27.34 64.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.861 1.264 . . . . 2.71 113.321 -179.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -92.38 -7.03 48.89 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 126.226 1.81 . . . . 2.3999999999999999 114.632 174.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 46.0 t -101.59 -60.76 1.47 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 126.669 1.988 . . . . 0.67000000000000004 112.785 -175.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.251 71.2 p 48.88 27.94 1.78 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 127.113 2.165 . . . . 1.0900000000000001 116.258 178.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -58.94 -79.52 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.384 1.873 . . . . 2.6200000000000001 112.457 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -150.99 -44.92 0.12 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.871 1.268 . . . . 3.8500000000000001 111.406 -168.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.7 mt -126.16 157.13 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 C-N-CA 125.779 1.631 . . . . 1.8999999999999999 107.135 174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' CE1' ' A' ' 30' ' ' PHE . 0.0 OUTLIER -31.67 95.15 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 127.25 2.22 . . . . 1.8100000000000001 113.02 168.383 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 50.43 46.86 45.0 Favored Glycine 0 CA--C 1.531 1.076 0 CA-C-O 118.899 -0.945 . . . . 1.3700000000000001 114.314 -178.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 p -65.81 -2.36 3.69 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.17 1.915 . . . . 1.4399999999999999 116.17 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 p30 -116.04 17.9 15.68 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.176 1.391 . . . . 2.9700000000000002 114.474 162.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 10.6 m -131.96 17.8 4.62 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 128.222 2.609 . . . . 0.69999999999999996 111.953 -170.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 m -65.52 -26.54 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 O-C-N 121.243 -0.91 . . . . 2.1099999999999999 113.445 -159.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -51.48 -35.69 41.15 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.677 1.191 . . . . 2.23 113.373 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -71.46 -41.96 68.76 Favored 'General case' 0 CA--C 1.546 0.79 0 O-C-N 121.234 -0.916 . . . . 1.1200000000000001 112.647 177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -69.38 -32.4 71.41 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.483 -1.386 . . . . 1.72 111.703 172.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 31.8 ttp180 -60.85 -40.78 94.18 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 125.157 1.383 . . . . 5.6399999999999997 111.618 172.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -67.91 -35.14 77.95 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.778 1.231 . . . . 0.63 112.768 170.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.6 -47.22 86.46 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 123.191 0.596 . . . . 2.3300000000000001 111.836 174.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 18.9 tp60 -64.88 -47.81 76.53 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.898 0.772 . . . . 3.0499999999999998 111.608 174.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -55.42 -30.18 59.99 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.581 1.552 . . . . 3.0600000000000001 114.675 175.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 50.7 t -86.03 -39.76 16.49 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 122.05 -0.406 . . . . 0.68999999999999995 111.769 172.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 52.1 mtt -79.74 -21.0 45.06 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.734 -1.854 . . . . 2.0 112.078 -168.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.56 -11.81 12.77 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 126.584 1.954 . . . . 1.6000000000000001 113.368 168.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.57 -40.31 50.03 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.17 1.788 . . . . 3.7200000000000002 114.582 173.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -136.39 119.22 12.02 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 118.884 0.765 . . . . 2.1899999999999999 111.904 -164.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -88.7 -31.84 0.16 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 122.235 1.957 . . . . 2.2200000000000002 116.313 -171.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -161.93 75.85 0.48 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 123.049 1.404 . . . . 4.0300000000000002 112.012 -179.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.299 1.2 tm? -138.03 -8.41 1.58 Allowed 'General case' 0 CA--C 1.558 1.283 0 CA-C-N 114.246 -1.343 . . . . 1.99 111.61 -161.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.442 ' CG ' ' HD2' ' A' ' 18' ' ' PRO . 6.6 p90 . . . . . 0 C--O 1.257 1.457 0 C-N-CA 127.466 2.307 . . . . 3.1699999999999999 114.478 -166.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 N--CA 1.481 1.108 0 CA-C-O 119.782 -0.152 . . . . 13.130000000000001 111.344 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -82.22 55.62 2.92 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.0 1.32 . . . . 10.369999999999999 111.837 -177.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -70.92 -40.87 71.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.135 0.974 . . . . 4.5700000000000003 112.092 -176.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . 0.426 ' HA2' HG22 ' B' ' 67' ' ' ILE . . . -80.16 18.41 8.11 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 116.222 1.249 . . . . 3.5 116.222 -171.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -63.37 -33.38 75.4 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 115.039 1.496 . . . . 5.4400000000000004 115.039 -168.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 27.4 mt -111.69 -23.47 10.63 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.775 1.23 . . . . 3.0600000000000001 113.272 175.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.426 HG22 ' HA2' ' B' ' 64' ' ' GLY . 13.2 tt -70.87 -25.6 26.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 N-CA-C 114.833 1.419 . . . . 1.8 114.833 -172.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 tp10 -70.65 -27.47 64.07 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 119.239 0.927 . . . . 4.54 110.507 171.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -79.79 -33.18 40.74 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.739 1.615 . . . . 1.25 113.786 169.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -55.96 -54.2 47.61 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 119.517 1.053 . . . . 1.24 109.005 167.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 60.7 tttt -55.54 -51.27 67.62 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 126.332 1.853 . . . . 5.2199999999999998 111.758 174.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.63 -48.69 71.96 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 118.812 0.733 . . . . 5.4699999999999998 111.214 -179.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 13.8 m -66.89 -47.93 70.32 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.925 0.89 . . . . 1.53 112.042 -176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 23.3 ptt? -72.1 -29.63 64.28 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.125 0.787 . . . . 3.3900000000000001 113.125 -179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 48.2 ttt85 -77.75 -40.27 41.52 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.254 1.022 . . . . 5.4800000000000004 112.04 176.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -59.1 -45.69 90.21 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.657 0.783 . . . . 1.0900000000000001 111.285 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.66 -46.38 85.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.13 0.418 . . . . 4.1299999999999999 112.13 174.072 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.9 -27.93 67.68 Favored Glycine 0 CA--C 1.539 1.542 0 CA-C-N 118.984 0.811 . . . . 2.23 114.39 177.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -82.12 -32.5 30.1 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.255 1.022 . . . . 3.48 112.63 172.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -72.84 -44.34 61.54 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.513 1.301 . . . . 3.8799999999999999 114.513 179.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.1 pt . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 117.898 -1.048 . . . . 4.8700000000000001 113.715 -173.913 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 9.0 t-20 . . . . . 0 N--CA 1.479 1.025 0 CA-C-O 118.212 -0.899 . . . . 4.46 111.067 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.13 14.68 59.59 Favored Glycine 0 CA--C 1.54 1.655 0 CA-C-N 120.141 1.337 . . . . 2.7200000000000002 115.906 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -74.23 167.95 20.59 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.116 1.766 . . . . 3.75 113.447 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.459 HD12 ' H ' ' A' ' 4' ' ' ILE . 3.4 mp -52.54 144.41 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 125.714 1.605 . . . . 3.0099999999999998 110.334 162.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -84.02 103.71 13.48 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.1 0.96 . . . . 2.0899999999999999 109.57 163.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.533 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 49.5 m95 -83.82 51.97 2.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.406 1.082 . . . . 2.3100000000000001 112.195 -171.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -146.61 157.35 43.7 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.74 1.616 . . . . 3.0499999999999998 110.183 -174.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 40.9 t 64.36 130.64 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.883 0 C-N-CA 127.535 2.334 . . . . 4.9000000000000004 112.734 -154.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -69.43 -14.46 37.17 Favored 'Trans proline' 0 C--N 1.353 0.765 0 C-N-CA 123.165 2.577 . . . . 5.5800000000000001 115.942 -159.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.4 p -57.11 -51.21 70.21 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 119.789 1.177 . . . . 3.1499999999999999 112.812 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.3 tt -95.57 -31.42 13.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.839 1.656 . . . . 1.8300000000000001 110.666 166.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -53.83 -43.32 70.47 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.391 0.996 . . . . 1.3200000000000001 114.658 -179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.44 -34.67 89.88 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-N 118.784 1.292 . . . . 1.3600000000000001 113.403 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 2.2 tpt -63.29 -43.61 97.38 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.452 -1.028 . . . . 1.75 110.848 172.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -81.07 17.09 1.3 Allowed 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.404 1.882 . . . . 0.72999999999999998 115.005 172.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.8 m -116.25 -171.13 1.94 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 126.306 1.843 . . . . 1.27 110.832 174.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.02 -172.29 47.52 Favored Glycine 0 CA--C 1.547 2.068 0 O-C-N 120.518 -1.364 . . . . 0.73999999999999999 115.897 175.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -55.49 -32.69 83.44 Favored 'Trans proline' 0 C--N 1.35 0.616 1 C-N-CA 126.499 4.799 . . . . 1.47 115.435 171.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 m -121.35 20.97 11.2 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 124.574 1.149 . . . . 0.64000000000000001 111.481 -169.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.07 92.59 Favored Glycine 0 N--CA 1.467 0.761 0 N-CA-C 111.128 -0.789 . . . . 0.47999999999999998 111.128 -172.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.9 pm0 -61.69 -24.78 66.98 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.951 2.5 . . . . 4.0300000000000002 114.485 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -72.94 -36.57 67.21 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.105 0.562 . . . . 0.79000000000000004 110.642 168.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -65.44 -44.23 87.94 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 118.778 0.717 . . . . 2.2999999999999998 111.733 170.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 30.4 mmtp -51.09 -54.95 20.28 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.336 0.654 . . . . 1.0900000000000001 110.62 173.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.4 t -61.82 -44.3 97.13 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.192 1.397 . . . . 0.5 111.776 -178.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.8 26.63 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.001 -1.062 . . . . 0.33000000000000002 113.689 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -34.72 68.61 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.94 0.791 . . . . 2.1400000000000001 112.712 -177.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.8 p -65.85 -48.02 73.02 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.102 0.864 . . . . 1.24 111.563 170.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.1 t -59.98 -39.6 86.23 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 119.492 1.042 . . . . 0.53000000000000003 111.172 176.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.75 -47.14 80.76 Favored 'General case' 0 N--CA 1.477 0.902 0 O-C-N 120.165 -1.584 . . . . 2.3500000000000001 113.109 169.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -60.39 -35.62 76.16 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.517 1.127 . . . . 2.6200000000000001 113.256 177.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -83.1 -24.53 32.61 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.9 0.88 . . . . 2.1600000000000001 113.274 176.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 33.0 t -82.7 -63.12 1.43 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.554 1.542 . . . . 1.1599999999999999 113.534 -176.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . 0.298 46.4 p 52.86 27.78 5.81 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 116.465 2.024 . . . . 1.3600000000000001 116.465 178.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -59.68 -70.19 0.17 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.073 1.349 . . . . 3.1400000000000001 114.339 -174.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -164.84 -48.97 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.881 1.272 . . . . 3.3199999999999998 111.055 -173.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -99.66 158.62 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 126.65 1.98 . . . . 1.8400000000000001 107.987 174.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -57.5 98.13 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 120.258 1.39 . . . . 1.95 110.723 176.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 53.82 47.1 66.38 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-O 118.253 -1.304 . . . . 1.28 114.619 -174.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -53.46 -33.16 53.11 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 120.632 2.216 . . . . 1.53 115.269 175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -97.21 28.36 3.67 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 122.81 1.29 . . . . 3.2000000000000002 113.1 170.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 57.0 m -139.39 15.69 2.57 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 128.433 2.693 . . . . 0.59999999999999998 111.224 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 11.8 p -59.25 -28.25 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 125.185 1.394 . . . . 1.9299999999999999 113.134 -169.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -59.56 -29.42 67.91 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 119.225 0.92 . . . . 2.5699999999999998 112.834 177.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -75.21 -40.46 59.18 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.595 0.758 . . . . 0.58999999999999997 111.984 178.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -67.42 -40.1 85.5 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.889 0.876 . . . . 2.1000000000000001 111.032 173.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 53.1 ttt180 -57.22 -46.72 82.67 Favored 'General case' 0 C--O 1.223 -0.308 0 C-N-CA 124.647 1.179 . . . . 3.5600000000000001 111.204 171.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.01 -34.91 79.56 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.144 0.794 . . . . 0.51000000000000001 113.144 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 19.3 ttt -58.84 -51.35 70.37 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.326 0.966 . . . . 2.6000000000000001 111.341 172.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -60.66 -51.61 68.65 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-O 121.024 0.44 . . . . 3.1699999999999999 111.92 175.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.27 -21.54 64.01 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.822 2.449 . . . . 2.4300000000000002 114.382 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 45.1 t -89.54 -41.1 12.21 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.619 1.168 . . . . 0.64000000000000001 111.854 169.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 78.8 mtp -78.9 -19.61 51.44 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 120.287 -1.508 . . . . 3.23 111.655 -170.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -62.42 -14.38 40.04 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.727 1.611 . . . . 1.4299999999999999 113.866 170.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 17.6 mmmt -65.45 -37.68 87.6 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 119.355 0.98 . . . . 2.8199999999999998 113.327 172.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -142.75 132.24 11.97 Favored Pre-proline 0 CA--C 1.541 0.621 0 N-CA-C 113.729 1.011 . . . . 2.7000000000000002 113.729 -159.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -93.06 -36.11 0.04 OUTLIER 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.931 2.421 . . . . 2.3100000000000001 115.484 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -154.59 65.95 0.68 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 123.298 1.523 . . . . 5.1100000000000003 111.687 -157.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.27 0.3 OUTLIER -145.45 -8.54 0.58 Allowed 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 112.842 -1.981 . . . . 1.9099999999999999 110.587 -156.155 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--O 1.25 1.1 0 C-N-CA 127.487 2.315 . . . . 2.7400000000000002 112.983 -165.859 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.271 0.081 . . . . 11.57 111.151 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 68.4 t60 -59.28 -31.8 69.44 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.58 1.552 . . . . 10.970000000000001 113.891 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 38.4 t -157.66 148.63 21.29 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.488 1.515 . . . . 4.9900000000000002 110.611 -176.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 171.93 -7.39 0.04 OUTLIER Glycine 0 CA--C 1.537 1.451 0 N-CA-C 118.435 2.134 . . . . 3.1899999999999999 118.435 174.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 51.0 m80 -88.14 -43.09 11.91 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 120.265 2.033 . . . . 5.9100000000000001 113.928 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -59.07 -35.78 73.95 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 114.209 1.189 . . . . 3.4199999999999999 114.209 -173.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -32.02 53.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 124.006 0.922 . . . . 2.5299999999999998 112.69 -175.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.58 -35.46 80.57 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.349 -0.844 . . . . 3.9199999999999999 112.163 174.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.9 -24.6 26.56 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.845 1.258 . . . . 1.26 113.025 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -54.96 -53.33 57.0 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.748 1.158 . . . . 1.3100000000000001 108.399 163.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 52.7 mtpt -58.73 -58.62 7.79 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.688 1.195 . . . . 3.48 112.06 177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -64.33 -32.35 73.93 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 119.658 1.117 . . . . 4.7599999999999998 113.021 -175.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 35.8 m -72.95 -38.62 66.68 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 120.264 1.393 . . . . 1.9099999999999999 113.846 174.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 26.8 ptm -72.02 -26.13 62.09 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 120.116 1.326 . . . . 2.6099999999999999 112.896 172.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 27.6 mtp-105 -70.65 -37.37 73.73 Favored 'General case' 0 N--CA 1.471 0.614 0 O-C-N 121.354 -0.842 . . . . 4.7300000000000004 111.649 167.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -61.97 -44.44 96.74 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 119.271 0.941 . . . . 0.93999999999999995 111.676 172.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.37 -51.65 57.77 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 122.111 -0.368 . . . . 4.0099999999999998 110.439 167.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -53.97 -36.0 54.99 Favored Glycine 0 CA--C 1.54 1.613 0 CA-C-O 119.461 -0.633 . . . . 2.0499999999999998 114.635 174.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -80.56 -21.99 41.2 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.317 1.559 . . . . 5.3899999999999997 114.833 176.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -102.03 -27.29 13.02 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.601 1.704 . . . . 4.4199999999999999 115.601 -178.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 10.9 tp . . . . . 0 C--O 1.256 1.403 0 C-N-CA 125.205 1.402 . . . . 3.54 114.265 -171.766 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 58.6 t-20 . . . . . 0 N--CA 1.478 0.958 0 CA-C-O 119.863 -0.113 . . . . 5.4100000000000001 110.737 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 81.06 26.1 53.8 Favored Glycine 0 CA--C 1.534 1.253 0 O-C-N 121.376 -0.827 . . . . 3.8300000000000001 114.931 -175.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -57.22 170.24 0.5 Allowed 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 118.039 0.919 . . . . 3.5499999999999998 113.395 176.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.693 HG21 HD22 ' A' ' 11' ' ' LEU . 2.1 mp -51.67 151.88 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.93 0 C-N-CA 125.373 1.469 . . . . 3.02 109.954 157.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -84.72 113.26 21.18 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.769 -1.207 . . . . 2.9100000000000001 110.293 153.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.613 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 75.6 m95 -85.7 13.86 6.57 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.32 1.23 . . . . 1.8 114.32 -168.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -137.09 -49.85 0.63 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 115.113 1.523 . . . . 3.4700000000000002 115.113 -169.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.3 m -79.43 -34.74 0.93 Allowed Pre-proline 0 N--CA 1.476 0.835 0 N-CA-C 116.047 1.869 . . . . 4.79 116.047 -173.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -79.4 178.23 7.64 Favored 'Trans proline' 0 CA--C 1.545 1.048 0 C-N-CA 122.736 2.291 . . . . 7.2400000000000002 110.99 160.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 m -67.4 -0.57 3.77 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.036 -1.665 . . . . 3.75 114.746 -176.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.693 HD22 HG21 ' A' ' 4' ' ' ILE . 4.5 mp -63.3 -16.82 61.51 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 120.891 -1.13 . . . . 1.23 111.782 165.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -48.32 -51.45 21.0 Favored Glycine 0 CA--C 1.531 1.068 0 CA-C-N 119.613 1.097 . . . . 1.49 113.51 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.9 -17.49 75.4 Favored Glycine 0 CA--C 1.535 1.285 0 N-CA-C 116.009 1.164 . . . . 1.6000000000000001 116.009 173.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.5 tpt -101.71 -37.19 8.43 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 115.079 1.511 . . . . 2.2599999999999998 115.079 -171.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 23' ' ' PHE . . . -97.35 31.64 2.45 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.796 1.238 . . . . 0.68999999999999995 113.884 -166.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.4 m -138.89 -168.84 2.5 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.786 1.634 . . . . 1.3799999999999999 109.875 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.98 -173.96 53.63 Favored Glycine 0 CA--C 1.539 1.577 0 O-C-N 121.057 -1.027 . . . . 0.72999999999999998 113.563 -174.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -39.89 -53.71 2.3 Favored 'Trans proline' 0 CA--C 1.536 0.605 0 C-N-CA 124.307 3.338 . . . . 0.94999999999999996 114.478 163.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 m -96.73 16.54 18.78 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 114.05 1.13 . . . . 0.81000000000000005 114.05 -168.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -55.36 -46.28 80.57 Favored Glycine 0 CA--C 1.525 0.698 0 N-CA-C 111.088 -0.805 . . . . 0.44 111.088 -172.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -59.47 -26.39 65.21 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 126.982 2.113 . . . . 3.2799999999999998 114.042 177.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -70.16 -38.08 75.36 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.622 0.646 . . . . 1.0600000000000001 109.835 172.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.617 ' CE2' HD23 ' A' ' 11' ' ' LEU . 6.9 t80 -70.7 -38.92 73.69 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 112.662 0.615 . . . . 2.27 112.662 172.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.613 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 34.1 mmtp -54.21 -52.04 62.52 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.691 0.758 . . . . 0.65000000000000002 110.278 173.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 32.7 t -60.43 -46.02 91.53 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.783 1.633 . . . . 0.88 112.73 178.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -68.46 -55.97 10.0 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.447 1.099 . . . . 0.33000000000000002 113.903 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.419 ' CD2' HD21 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -71.62 -31.28 66.72 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.612 -0.709 . . . . 2.0600000000000001 112.632 -176.564 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 85.8 p -67.89 -44.69 76.43 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 119.477 1.035 . . . . 1.53 111.996 168.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 9.1 t -56.41 -42.4 77.96 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 119.732 1.151 . . . . 0.59999999999999998 111.953 174.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -58.1 -48.51 79.97 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.457 1.103 . . . . 2.3900000000000001 112.459 171.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 m170 -61.13 -30.49 70.41 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.395 0.998 . . . . 2.5600000000000001 113.271 177.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 16.9 m-85 -85.78 -11.78 52.63 Favored 'General case' 0 CA--C 1.55 0.951 0 N-CA-C 113.176 0.806 . . . . 2.8100000000000001 113.176 172.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.8 t -88.31 -65.71 0.99 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.393 1.877 . . . . 0.89000000000000001 112.299 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 81.0 p 50.44 37.63 16.15 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.591 1.556 . . . . 1.3300000000000001 114.313 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -76.0 -73.81 0.25 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.808 1.243 . . . . 2.6000000000000001 114.249 -177.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -165.94 -55.4 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.412 1.485 . . . . 2.9500000000000002 111.152 -173.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.4 mp -84.06 158.36 3.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 125.929 1.692 . . . . 1.6299999999999999 106.915 168.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -58.84 89.38 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 119.217 0.917 . . . . 1.8100000000000001 111.164 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.32 57.94 13.35 Favored Glycine 0 CA--C 1.537 1.443 0 CA-C-O 118.695 -1.059 . . . . 1.5 114.188 -169.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.8 m -41.43 -34.97 0.6 Allowed 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 119.31 1.555 . . . . 1.71 115.174 171.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 56.9 p30 -106.37 21.56 17.2 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 126.123 1.769 . . . . 2.9199999999999999 114.142 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 40.3 m -135.21 7.59 3.39 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 127.298 2.239 . . . . 0.69999999999999996 112.699 -171.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.5 m -64.52 -24.29 35.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 N-CA-C 113.359 0.874 . . . . 2.5600000000000001 113.359 -165.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -61.19 -24.31 66.23 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 119.687 1.13 . . . . 2.7799999999999998 113.426 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -74.68 -38.72 62.33 Favored 'General case' 0 CA--C 1.549 0.93 0 O-C-N 120.706 -1.246 . . . . 1.0700000000000001 112.255 172.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -69.68 -34.68 74.29 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 120.377 -1.452 . . . . 2.3599999999999999 110.962 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.27 -50.05 65.64 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 124.774 1.229 . . . . 4.3200000000000003 111.131 167.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.28 89.41 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.853 0.861 . . . . 0.90000000000000002 112.666 175.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.5 ttt -55.81 -54.17 47.75 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.809 -0.557 . . . . 2.7799999999999998 111.708 173.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -68.78 -41.41 78.82 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 119.55 -0.86 . . . . 3.29 113.289 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -57.14 -25.51 59.0 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 126.824 2.049 . . . . 3.3500000000000001 113.749 174.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 42.6 t -90.41 -39.75 12.47 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.341 1.056 . . . . 0.96999999999999997 112.281 170.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 56.6 mtt -78.56 -17.13 56.59 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.592 -1.317 . . . . 2.04 112.224 -171.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.2 pp0? -66.94 -16.76 64.55 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.998 2.119 . . . . 1.6599999999999999 113.477 167.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -77.65 -55.1 5.63 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.071 0.949 . . . . 2.4100000000000001 111.062 166.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.45 ' HB3' ' CG ' ' A' ' 59' ' ' LEU . 9.5 m-85 -115.97 103.24 53.62 Favored Pre-proline 0 CA--C 1.535 0.389 0 C-N-CA 123.655 0.782 . . . . 2.4199999999999999 111.563 -166.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -67.61 -40.82 9.49 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.521 2.814 . . . . 2.6299999999999999 114.227 -164.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -158.61 4.96 0.11 Allowed 'General case' 0 N--CA 1.477 0.923 0 CA-C-O 122.062 0.934 . . . . 4.8200000000000003 112.986 -167.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.45 ' CG ' ' HB3' ' A' ' 56' ' ' TYR . 0.4 OUTLIER -83.54 5.32 24.47 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.512 1.301 . . . . 2.4700000000000002 114.512 -139.681 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.3 p90 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 126.426 1.89 . . . . 3.5299999999999998 113.327 -158.496 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 N--CA 1.475 0.806 0 CA-C-O 121.255 0.55 . . . . 12.119999999999999 111.243 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -70.77 -22.46 62.39 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.964 1.306 . . . . 13.23 113.798 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 32.8 t -76.01 126.35 30.84 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.669 1.587 . . . . 5.7999999999999998 110.743 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . -103.24 -37.35 3.12 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.036 0.827 . . . . 4.3300000000000001 114.335 179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -46.17 -21.25 0.14 Allowed 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 118.919 2.933 . . . . 5.1100000000000003 118.919 -163.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . 0.273 0.4 OUTLIER -135.09 -19.26 1.75 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 120.5 1.5 . . . . 2.73 114.853 170.151 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 16.4 tt -70.66 -33.01 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 CA-C-N 120.986 1.721 . . . . 2.5 114.243 -174.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -62.76 -38.06 89.08 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.915 172.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.75 -32.21 69.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.559 1.143 . . . . 1.5600000000000001 112.85 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -62.8 -49.01 76.66 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 119.581 1.082 . . . . 1.3200000000000001 111.188 172.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 59.8 tttp -60.88 -49.72 76.34 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.451 1.101 . . . . 4.9400000000000004 111.591 176.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 19.1 tp10 -53.68 -49.9 67.01 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.647 1.179 . . . . 4.21 111.201 175.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 48.8 m -65.73 -47.8 74.1 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 123.344 0.658 . . . . 1.6299999999999999 112.24 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -35.18 73.01 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.681 1.128 . . . . 2.8599999999999999 112.655 -177.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 6.2 tmm_? -65.96 -50.63 63.68 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 121.666 -0.646 . . . . 5.25 111.428 172.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.76 -48.96 64.9 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.111 0.782 . . . . 1.28 113.111 -177.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.6 -37.95 73.92 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 118.511 -0.757 . . . . 4.7599999999999998 111.729 179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.96 -27.11 73.5 Favored Glycine 0 CA--C 1.538 1.471 0 CA-C-N 119.673 1.124 . . . . 3.25 113.932 174.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -68.8 -43.39 75.74 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 119.003 1.401 . . . . 4.4900000000000002 112.383 164.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 63.4 tttm -75.58 -53.84 7.97 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.368 1.467 . . . . 3.2999999999999998 114.698 -171.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . 0.285 23.3 pt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 128.819 2.848 . . . . 6.8499999999999996 115.668 -176.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 112.823 0.675 . . . . 4.2999999999999998 112.823 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 64.93 -13.64 0.2 Allowed Glycine 0 CA--C 1.546 2.005 0 C-N-CA 125.99 1.757 . . . . 2.1200000000000001 116.816 -178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -69.98 165.81 20.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 129.911 3.284 . . . . 2.8399999999999999 115.743 -165.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.0 mp -83.77 149.14 4.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.892 1.277 . . . . 2.8500000000000001 108.244 159.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -94.26 108.1 20.01 Favored 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 124.626 1.17 . . . . 2.3599999999999999 110.077 165.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.509 ' CH2' ' HA ' ' A' ' 24' ' ' LYS . 48.8 m95 -85.64 32.53 0.58 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.864 1.265 . . . . 1.8 112.924 -167.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -90.04 133.35 34.88 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 126.498 1.919 . . . . 2.8799999999999999 113.128 -163.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.4 p 60.51 173.58 0.05 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 127.926 2.49 . . . . 5.3799999999999999 116.693 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -65.51 21.94 0.08 OUTLIER 'Trans proline' 0 CA--C 1.547 1.159 1 C-N-CA 125.375 4.05 . . . . 7.4500000000000002 117.051 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 78.5 m -82.91 -127.41 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.974 2.11 . . . . 4.2000000000000002 110.155 173.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.8 tt -55.53 -34.41 64.65 Favored 'General case' 0 CA--C 1.546 0.795 0 O-C-N 120.801 -1.187 . . . . 1.6899999999999999 110.835 170.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.47 -22.77 25.03 Favored Glycine 0 CA--C 1.541 1.703 0 C-N-CA 125.198 1.38 . . . . 1.3799999999999999 115.662 169.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.37 -36.02 55.67 Favored Glycine 0 CA--C 1.535 1.34 0 CA-C-N 118.994 1.397 . . . . 1.24 113.605 169.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 39.7 tpp -71.23 -33.8 70.19 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 121.223 -1.163 . . . . 2.0699999999999998 111.602 168.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.429 ' HB1' ' CE ' ' A' ' 24' ' ' LYS . . . -86.42 30.75 0.69 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.988 2.115 . . . . 0.90000000000000002 113.369 172.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 58.8 m -137.04 167.75 20.91 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.787 1.635 . . . . 1.1100000000000001 110.583 171.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 102.84 -177.1 25.31 Favored Glycine 0 CA--C 1.539 1.553 0 N-CA-C 115.295 0.878 . . . . 0.69999999999999996 115.295 177.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -42.09 -25.84 0.44 Allowed 'Trans proline' 0 C--N 1.35 0.631 1 C-N-CA 127.371 5.38 . . . . 1.03 117.894 168.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 61.7 m -138.04 18.8 2.81 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 124.91 1.284 . . . . 0.73999999999999999 111.634 -173.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -54.84 -40.19 71.11 Favored Glycine 0 CA--C 1.531 1.034 0 N-CA-C 111.324 -0.71 . . . . 0.46999999999999997 111.324 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -59.45 -28.19 66.75 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.737 2.415 . . . . 4.0800000000000001 114.624 174.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mm-40 -70.37 -35.46 73.54 Favored 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 122.674 0.39 . . . . 0.68000000000000005 110.501 170.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -69.01 -39.5 79.27 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.438 0.533 . . . . 2.2000000000000002 112.438 171.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.509 ' HA ' ' CH2' ' A' ' 6' ' ' TRP . 31.7 mmtp -54.73 -51.69 64.85 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.235 0.614 . . . . 0.71999999999999997 109.864 172.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 42.9 t -59.92 -48.25 82.45 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.268 1.827 . . . . 0.71999999999999997 113.21 178.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -70.22 -53.59 16.4 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 125.101 1.36 . . . . 0.31 113.129 -177.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.89 -32.75 69.8 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.527 -0.749 . . . . 1.98 111.714 -178.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.9 t -58.71 -53.23 60.72 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.346 0.975 . . . . 1.5700000000000001 110.897 166.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.8 t -60.47 -38.35 83.96 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 120.672 -1.268 . . . . 0.45000000000000001 111.509 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -58.08 -47.09 84.26 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 120.445 -1.409 . . . . 2.4500000000000002 113.003 169.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -58.6 -43.21 89.5 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 119.005 0.82 . . . . 2.7599999999999998 111.945 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -75.71 -9.52 58.66 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 125.095 1.358 . . . . 2.5899999999999999 114.126 175.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 45.2 t -94.84 -71.24 0.67 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.335 1.854 . . . . 0.81000000000000005 112.301 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 69.2 p 47.4 42.24 13.85 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.883 1.273 . . . . 1.25 113.872 -173.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.13 -71.44 0.41 Allowed 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.045 0.938 . . . . 3.4100000000000001 112.608 -176.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -159.69 -51.05 0.06 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.431 1.092 . . . . 3.3300000000000001 112.107 -171.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 77.0 mt -109.83 149.66 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 125.666 1.586 . . . . 1.8600000000000001 107.741 173.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.83 103.13 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.132 0.973 . . . . 2.0600000000000001 111.397 -178.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.57 41.53 97.31 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.563 -1.132 . . . . 1.1399999999999999 114.916 -176.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.6 p -62.26 -12.63 21.62 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.631 2.215 . . . . 1.3300000000000001 115.393 174.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -93.95 11.41 29.68 Favored 'General case' 0 CA--C 1.553 1.067 0 O-C-N 120.976 -1.077 . . . . 2.1699999999999999 113.382 166.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 87.5 m -153.35 13.3 0.49 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.179 1.392 . . . . 0.42999999999999999 113.569 -157.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 6.0 m -62.77 -25.93 39.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.112 -0.993 . . . . 2.1600000000000001 113.001 -165.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 30.2 t0 -58.88 -28.53 66.22 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.907 1.683 . . . . 1.8999999999999999 112.927 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -76.19 -38.78 56.1 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 121.231 -0.918 . . . . 0.89000000000000001 111.845 176.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -70.81 -33.91 71.19 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.44 1.096 . . . . 1.78 111.853 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 47.8 ttt180 -54.81 -51.68 65.05 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 123.758 0.823 . . . . 4.0300000000000002 110.23 167.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.68 -34.63 78.65 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.659 0.985 . . . . 0.68999999999999995 113.659 175.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.7 ttt -52.33 -57.88 8.38 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 119.343 0.974 . . . . 2.6600000000000001 110.432 171.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -71.32 -42.81 68.13 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 113.922 1.082 . . . . 4.6699999999999999 113.922 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.33 -21.13 61.69 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 127.488 2.315 . . . . 3.7400000000000002 113.561 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 22.1 t -94.93 -43.34 8.22 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.243 -0.91 . . . . 0.73999999999999999 112.138 168.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 55.5 mtt -73.26 -18.64 61.2 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 119.896 -1.752 . . . . 2.48 111.414 -169.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -53.28 -30.18 37.28 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.566 1.547 . . . . 2.0299999999999998 113.123 165.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -59.83 -27.71 66.86 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.157 1.783 . . . . 3.3399999999999999 114.649 -176.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -144.25 123.75 7.27 Favored Pre-proline 0 CA--C 1.536 0.411 0 C-N-CA 124.234 1.013 . . . . 3.1400000000000001 111.002 -172.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.94 -38.55 0.15 Allowed 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 121.947 1.765 . . . . 2.3599999999999999 114.759 -175.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -158.07 60.14 0.46 Allowed 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 123.12 1.438 . . . . 4.1299999999999999 114.226 -165.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . 0.252 1.0 OUTLIER -134.38 -7.52 2.57 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.273 -1.785 . . . . 2.2999999999999998 112.024 -156.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 126.924 2.09 . . . . 2.9500000000000002 110.338 -170.207 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.481 1.116 0 CA-C-O 119.345 -0.36 . . . . 17.280000000000001 111.431 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' HIS . . . . . . . . . . . . . 53.3 t60 68.83 142.83 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 127.914 2.486 . . . . 9.5099999999999998 115.228 -175.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.41 125.22 23.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.33 1.452 . . . . 5.3799999999999999 112.282 -175.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.37 8.94 87.09 Favored Glycine 0 CA--C 1.534 1.225 0 N-CA-C 115.442 0.937 . . . . 4.2400000000000002 115.442 175.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' HIS . . . . . . . . . . . . . 7.0 t-80 -55.22 -48.02 74.49 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.034 1.333 . . . . 4.9100000000000001 112.9 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' LEU . . . . . . . . . . . . . 92.0 mt -75.21 -5.34 43.94 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 115.496 1.665 . . . . 3.8599999999999999 115.496 -167.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 37.8 mm -55.6 -46.16 79.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 CA-C-N 121.075 1.761 . . . . 3.1299999999999999 113.932 -172.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . 11.5 mp0 -68.71 -26.31 65.21 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 120.553 -1.342 . . . . 4.8399999999999999 112.969 177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -76.31 -33.54 59.04 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.567 1.147 . . . . 1.3 112.754 170.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.63 -49.67 76.84 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 119.425 1.011 . . . . 1.27 109.497 170.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -56.96 -57.66 11.54 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.691 1.597 . . . . 4.9000000000000004 112.152 176.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -62.35 -38.69 90.49 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 122.104 -0.372 . . . . 4.4800000000000004 111.899 -176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . . . . . . . . . 51.0 m -70.78 -45.16 65.21 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.701 0.8 . . . . 1.6899999999999999 113.105 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -36.24 81.52 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 119.157 0.889 . . . . 3.7599999999999998 111.029 179.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' ARG . . . . . . . . . . . . . 75.9 ttt-85 -65.08 -41.24 95.23 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 118.413 0.551 . . . . 5.9400000000000004 111.951 171.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -62.26 -44.97 95.32 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.531 1.06 . . . . 1.3300000000000001 112.57 176.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 90.3 mt -60.1 -41.54 92.75 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.413 -0.805 . . . . 3.6899999999999999 111.282 171.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.31 -33.74 81.88 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.443 1.021 . . . . 2.1800000000000002 114.142 175.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -75.61 -35.99 60.38 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.454 1.127 . . . . 4.0999999999999996 112.712 172.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 93.4 mttt -86.0 -19.33 30.53 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.733 1.753 . . . . 4.5300000000000002 115.733 -175.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 8.8 tp . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 114.548 1.314 . . . . 4.5599999999999996 114.548 177.08 . . . . . . . . 0 0 . 1 stop_ save_