data_1kmr_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 1kmr _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 5.8 mt . . . . . 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.532 5.9 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 6.2 mt . . . . . 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.547 6.3 ppt_? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.562 5.4 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.428 5.6 ppt_? . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.556 5.4 mt . . . . . 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.559 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.548 5.6 mt . . . . . 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.591 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 5.4 mt . . . . . 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 5.9 ppt_? . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.555 5.8 mt . . . . . 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.9 mt . . . . . 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.564 5.2 mt . . . . . 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.6 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 2.1 mp . . . . . 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.521 5.8 ppt_? . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.414 ' H ' HD13 ' A' ' 15' ' ' ILE 0.399 4.7 ppt_? . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.414 HD13 ' H ' ' A' ' 12' ' ' ARG . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.582 1.7 mp . . . . . 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.415 5.4 ppt_? . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.58 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.429 ' H ' HD12 ' A' ' 15' ' ' ILE 0.401 4.8 ppt_? . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 12' ' ' ARG . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? -139.63 -132.28 0.12 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -170.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 5.8 mt -76.37 -64.01 0.54 Allowed Pre-proline 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -129.32 14.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.646 0 C-N-CA 123.606 2.871 . . . . 0.0 117.849 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.314 0.3 OUTLIER 60.86 59.39 2.1 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 125.492 1.517 . . . . 0.0 113.716 -177.542 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.614 173.398 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 p . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.532 5.9 ppt_? -143.48 -128.74 0.09 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 -169.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 6.2 mt -76.11 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -129.45 15.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.686 0 C-N-CA 123.57 2.847 . . . . 0.0 117.832 175.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.315 0.3 OUTLIER 61.01 59.76 1.97 Allowed 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 125.536 1.534 . . . . 0.0 113.663 -177.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 173.217 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.7 m . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.547 6.3 ppt_? -138.25 -131.09 0.13 Allowed 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 -171.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt -76.19 -63.85 0.57 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -129.04 13.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.557 0 C-N-CA 123.522 2.815 . . . . 0.0 118.141 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.68 57.78 2.61 Favored 'General case' 0 CA--C 1.569 1.697 0 C-N-CA 125.277 1.431 . . . . 0.0 113.755 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.332 0 CA-C-O 118.538 -1.146 . . . . 0.0 110.897 174.599 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? -135.69 -136.4 0.15 Allowed 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -172.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.562 5.4 mt -76.49 -63.79 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -128.76 13.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.558 0 C-N-CA 123.466 2.777 . . . . 0.0 118.145 175.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.77 57.86 2.55 Favored 'General case' 0 CA--C 1.569 1.683 0 C-N-CA 125.264 1.426 . . . . 0.0 113.748 -177.95 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 174.599 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.428 5.6 ppt_? -145.84 -131.43 0.07 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -171.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.556 5.4 mt -75.13 -63.81 0.67 Allowed Pre-proline 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -129.17 4.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.584 0 C-N-CA 123.512 2.808 . . . . 0.0 117.931 176.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.406 0.2 OUTLIER 76.92 -71.73 0.11 Allowed 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.915 1.686 . . . . 0.0 112.385 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 CA-C-O 118.849 -0.973 . . . . 0.0 111.776 170.726 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.1 t . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? -144.22 -132.4 0.08 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -172.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.559 5.7 mt -76.19 -63.96 0.56 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -128.74 13.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.568 0 C-N-CA 123.425 2.75 . . . . 0.0 118.052 175.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.307 0.3 OUTLIER 61.28 58.53 2.15 Favored 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.239 1.415 . . . . 0.0 113.579 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 174.448 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? -139.04 -139.25 0.14 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.548 5.6 mt -74.69 -63.68 0.75 Allowed Pre-proline 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -129.18 3.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.345 0 C-N-CA 123.589 2.859 . . . . 0.0 118.357 175.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.425 0.0 OUTLIER 46.93 56.95 6.1 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 179.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.223 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 175.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.551 1.016 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.591 0.0 OUTLIER -138.39 -131.67 0.13 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -172.675 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 5.4 mt -75.9 -63.82 0.6 Allowed Pre-proline 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -129.51 12.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.562 0 C-N-CA 123.505 2.803 . . . . 0.0 118.148 175.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.299 0.4 OUTLIER 60.23 57.36 2.95 Favored 'General case' 0 CA--C 1.57 1.714 0 C-N-CA 125.311 1.445 . . . . 0.0 113.853 -177.483 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 CA-C-O 118.658 -1.079 . . . . 0.0 110.995 174.806 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.7 m . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 5.9 ppt_? -141.75 -128.05 0.1 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -170.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.555 5.8 mt -76.55 -64.04 0.52 Allowed Pre-proline 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -127.97 18.47 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.679 0 C-N-CA 123.629 2.886 . . . . 0.0 117.592 174.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.329 0.1 OUTLIER 63.8 60.93 1.01 Allowed 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.61 1.564 . . . . 0.0 113.369 -179.665 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.005 170.949 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.1 p . . . . . 0 CA--C 1.551 0.988 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? -136.99 -133.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -173.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.9 mt -76.17 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -129.15 17.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.718 0 C-N-CA 123.763 2.975 . . . . 0.0 117.67 174.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.319 0.2 OUTLIER 61.06 60.5 1.79 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 125.552 1.541 . . . . 0.0 113.675 -177.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 CA-C-O 118.659 -1.079 . . . . 0.0 111.905 172.821 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? -135.02 -137.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 -172.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.564 5.2 mt -76.5 -63.69 0.55 Allowed Pre-proline 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -128.88 13.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.625 0 C-N-CA 123.496 2.797 . . . . 0.0 118.001 175.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.305 0.3 OUTLIER 60.64 58.17 2.52 Favored 'General case' 0 CA--C 1.569 1.692 0 C-N-CA 125.317 1.447 . . . . 0.0 113.763 -178.079 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 174.191 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? -141.86 -132.91 0.1 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 -169.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.6 mt -76.43 -63.96 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -128.95 16.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.631 0 C-N-CA 123.642 2.895 . . . . 0.0 117.679 175.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.316 0.2 OUTLIER 61.16 60.09 1.85 Allowed 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 125.563 1.545 . . . . 0.0 113.651 -177.87 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.632 172.893 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.551 1.014 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? -141.09 -134.76 0.11 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -172.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 2.1 mp -76.51 -63.48 0.57 Allowed Pre-proline 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -129.03 17.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.703 0 C-N-CA 123.828 3.019 . . . . 0.0 117.631 174.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.337 0.1 OUTLIER 64.28 60.54 0.95 Allowed 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 125.743 1.617 . . . . 0.0 113.355 -179.334 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.418 0 CA-C-O 118.487 -1.174 . . . . 0.0 111.637 170.854 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.551 0.996 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.521 5.8 ppt_? -142.0 -127.7 0.1 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -169.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt -76.0 -64.39 0.53 Allowed Pre-proline 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -130.43 23.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.503 0 C-N-CA 123.64 2.893 . . . . 0.0 118.149 177.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER 80.62 52.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 125.759 1.623 . . . . 0.0 113.148 168.476 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.843 177.056 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.8 m . . . . . 0 CA--C 1.552 1.019 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' H ' HD13 ' A' ' 15' ' ' ILE 0.399 4.7 ppt_? -148.23 -128.12 0.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -170.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.414 HD13 ' H ' ' A' ' 12' ' ' ARG . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.582 1.7 mp -70.35 -60.89 3.02 Favored Pre-proline 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.701 2.934 . . . . 0.0 118.68 176.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -126.82 82.93 2.12 Favored 'General case' 0 CA--C 1.559 1.292 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.863 -176.334 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 CA--C 1.552 1.033 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.415 5.4 ppt_? -145.83 -131.95 0.07 Allowed 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -172.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 24' ' ' LYS 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.58 1.7 mp -70.33 -60.89 3.02 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.581 0 C-N-CA 123.662 2.908 . . . . 0.0 118.686 176.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 19' ' ' GLN . 2.8 mtmp? -126.63 83.04 2.13 Favored 'General case' 0 CA--C 1.559 1.294 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 CA-C-O 118.686 -1.064 . . . . 0.0 112.889 -176.463 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.429 ' H ' HD12 ' A' ' 15' ' ' ILE 0.401 4.8 ppt_? -148.2 -128.14 0.06 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -170.039 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 12' ' ' ARG . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp -70.39 -60.77 3.06 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.454 ' HD2' ' HZ1' ' A' ' 24' ' ' LYS . 34.7 Cg_endo -113.72 -26.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.552 1.415 0 C-N-CA 123.633 2.889 . . . . 0.0 118.506 177.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.454 ' HZ1' ' HD2' ' A' ' 23' ' ' PRO . 0.3 OUTLIER -111.82 87.25 2.51 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 CA-C-O 119.254 -0.748 . . . . 0.0 112.439 -175.618 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.474 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 5.8 mt . . . . . 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.532 5.9 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.475 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 6.2 mt . . . . . 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.547 6.3 ppt_? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.48 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.562 5.4 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.428 5.6 ppt_? . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.561 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.556 5.4 mt . . . . . 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.483 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.559 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.548 5.6 mt . . . . . 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.591 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 5.4 mt . . . . . 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 5.9 ppt_? . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.466 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.555 5.8 mt . . . . . 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.9 mt . . . . . 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.564 5.2 mt . . . . . 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.468 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.6 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.476 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 2.1 mp . . . . . 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.521 5.8 ppt_? . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.399 4.7 ppt_? . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.533 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.582 1.7 mp . . . . . 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.415 5.4 ppt_? . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.532 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.58 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.401 4.8 ppt_? . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.553 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? -139.63 -132.28 0.12 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -170.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.474 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 5.8 mt -76.37 -64.01 0.54 Allowed Pre-proline 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HG22 ' A' ' 22' ' ' ILE . 85.4 Cg_endo -129.32 14.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.646 0 C-N-CA 123.606 2.871 . . . . 0.0 117.849 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.314 0.3 OUTLIER 60.86 59.39 2.1 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 125.492 1.517 . . . . 0.0 113.716 -177.542 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.614 173.398 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 p . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 15' ' ' ILE 0.532 5.9 ppt_? -143.48 -128.74 0.09 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 -169.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.475 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 6.2 mt -76.11 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HG22 ' A' ' 22' ' ' ILE . 83.0 Cg_endo -129.45 15.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.686 0 C-N-CA 123.57 2.847 . . . . 0.0 117.832 175.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.315 0.3 OUTLIER 61.01 59.76 1.97 Allowed 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 125.536 1.534 . . . . 0.0 113.663 -177.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 173.217 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.7 m . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.405 ' H ' HD13 ' A' ' 15' ' ' ILE 0.547 6.3 ppt_? -138.25 -131.09 0.13 Allowed 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 -171.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.464 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.561 5.7 mt -76.19 -63.85 0.57 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.464 ' HD3' HG22 ' A' ' 22' ' ' ILE . 88.8 Cg_endo -129.04 13.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.557 0 C-N-CA 123.522 2.815 . . . . 0.0 118.141 175.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.68 57.78 2.61 Favored 'General case' 0 CA--C 1.569 1.697 0 C-N-CA 125.277 1.431 . . . . 0.0 113.755 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.332 0 CA-C-O 118.538 -1.146 . . . . 0.0 110.897 174.599 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? -135.69 -136.4 0.15 Allowed 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -172.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.471 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.562 5.4 mt -76.49 -63.79 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.471 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.9 Cg_endo -128.76 13.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.558 0 C-N-CA 123.466 2.777 . . . . 0.0 118.145 175.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.77 57.86 2.55 Favored 'General case' 0 CA--C 1.569 1.683 0 C-N-CA 125.264 1.426 . . . . 0.0 113.748 -177.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 174.599 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' H ' HD13 ' A' ' 15' ' ' ILE 0.428 5.6 ppt_? -145.84 -131.43 0.07 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -171.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.561 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.483 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.556 5.4 mt -75.13 -63.81 0.67 Allowed Pre-proline 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.483 ' HD3' HG22 ' A' ' 22' ' ' ILE . 89.5 Cg_endo -129.17 4.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.584 0 C-N-CA 123.512 2.808 . . . . 0.0 117.931 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.406 0.2 OUTLIER 76.92 -71.73 0.11 Allowed 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.915 1.686 . . . . 0.0 112.385 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 CA-C-O 118.849 -0.973 . . . . 0.0 111.776 170.726 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.1 t . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? -144.22 -132.4 0.08 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -172.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.483 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.463 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.559 5.7 mt -76.19 -63.96 0.56 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.463 ' HD3' HG22 ' A' ' 22' ' ' ILE . 91.3 Cg_endo -128.74 13.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.568 0 C-N-CA 123.425 2.75 . . . . 0.0 118.052 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.307 0.3 OUTLIER 61.28 58.53 2.15 Favored 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.239 1.415 . . . . 0.0 113.579 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 174.448 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? -139.04 -139.25 0.14 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.497 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.548 5.6 mt -74.69 -63.68 0.75 Allowed Pre-proline 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.497 ' HD3' HG22 ' A' ' 22' ' ' ILE . 87.7 Cg_endo -129.18 3.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.345 0 C-N-CA 123.589 2.859 . . . . 0.0 118.357 175.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.425 0.0 OUTLIER 46.93 56.95 6.1 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 179.67 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.223 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 175.983 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.551 1.016 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.416 ' H ' HD13 ' A' ' 15' ' ' ILE 0.591 0.0 OUTLIER -138.39 -131.67 0.13 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -172.675 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.443 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.566 5.4 mt -75.9 -63.82 0.6 Allowed Pre-proline 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.443 ' HD3' HG22 ' A' ' 22' ' ' ILE . 84.6 Cg_endo -129.51 12.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.562 0 C-N-CA 123.505 2.803 . . . . 0.0 118.148 175.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.299 0.4 OUTLIER 60.23 57.36 2.95 Favored 'General case' 0 CA--C 1.57 1.714 0 C-N-CA 125.311 1.445 . . . . 0.0 113.853 -177.483 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 CA-C-O 118.658 -1.079 . . . . 0.0 110.995 174.806 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.7 m . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.435 ' H ' HD13 ' A' ' 15' ' ' ILE 0.526 5.9 ppt_? -141.75 -128.05 0.1 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -170.009 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.466 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.476 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.555 5.8 mt -76.55 -64.04 0.52 Allowed Pre-proline 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.476 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.9 Cg_endo -127.97 18.47 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.679 0 C-N-CA 123.629 2.886 . . . . 0.0 117.592 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.329 0.1 OUTLIER 63.8 60.93 1.01 Allowed 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.61 1.564 . . . . 0.0 113.369 -179.665 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.005 170.949 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.1 p . . . . . 0 CA--C 1.551 0.988 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? -136.99 -133.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -173.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.484 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.553 5.9 mt -76.17 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.484 ' HD3' HG22 ' A' ' 22' ' ' ILE . 84.8 Cg_endo -129.15 17.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.718 0 C-N-CA 123.763 2.975 . . . . 0.0 117.67 174.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.319 0.2 OUTLIER 61.06 60.5 1.79 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 125.552 1.541 . . . . 0.0 113.675 -177.813 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 CA-C-O 118.659 -1.079 . . . . 0.0 111.905 172.821 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? -135.02 -137.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 -172.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.479 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.564 5.2 mt -76.5 -63.69 0.55 Allowed Pre-proline 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.479 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.6 Cg_endo -128.88 13.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.625 0 C-N-CA 123.496 2.797 . . . . 0.0 118.001 175.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.305 0.3 OUTLIER 60.64 58.17 2.52 Favored 'General case' 0 CA--C 1.569 1.692 0 C-N-CA 125.317 1.447 . . . . 0.0 113.763 -178.079 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 174.191 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? -141.86 -132.91 0.1 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 -169.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.468 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.483 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.553 5.6 mt -76.43 -63.96 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.483 ' HD3' HG22 ' A' ' 22' ' ' ILE . 89.1 Cg_endo -128.95 16.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.631 0 C-N-CA 123.642 2.895 . . . . 0.0 117.679 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.316 0.2 OUTLIER 61.16 60.09 1.85 Allowed 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 125.563 1.545 . . . . 0.0 113.651 -177.87 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.632 172.893 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.551 1.014 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? -141.09 -134.76 0.11 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -172.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.476 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.52 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 2.1 mp -76.51 -63.48 0.57 Allowed Pre-proline 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.52 ' HD3' HG22 ' A' ' 22' ' ' ILE . 85.7 Cg_endo -129.03 17.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.703 0 C-N-CA 123.828 3.019 . . . . 0.0 117.631 174.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.337 0.1 OUTLIER 64.28 60.54 0.95 Allowed 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 125.743 1.617 . . . . 0.0 113.355 -179.334 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.418 0 CA-C-O 118.487 -1.174 . . . . 0.0 111.637 170.854 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.551 0.996 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.449 ' H ' HD13 ' A' ' 15' ' ' ILE 0.521 5.8 ppt_? -142.0 -127.7 0.1 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -169.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.437 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.561 5.7 mt -76.0 -64.39 0.53 Allowed Pre-proline 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.437 ' HD3' HG22 ' A' ' 22' ' ' ILE . 90.1 Cg_endo -130.43 23.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.503 0 C-N-CA 123.64 2.893 . . . . 0.0 118.149 177.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER 80.62 52.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 125.759 1.623 . . . . 0.0 113.148 168.476 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.843 177.056 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.8 m . . . . . 0 CA--C 1.552 1.019 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.462 ' H ' HD13 ' A' ' 15' ' ' ILE 0.399 4.7 ppt_? -148.23 -128.12 0.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -170.5 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.533 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.427 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.582 1.7 mp -70.35 -60.89 3.02 Favored Pre-proline 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.427 ' HD3' HG22 ' A' ' 22' ' ' ILE . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.701 2.934 . . . . 0.0 118.68 176.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -126.82 82.93 2.12 Favored 'General case' 0 CA--C 1.559 1.292 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.863 -176.334 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 CA--C 1.552 1.033 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.423 ' H ' HD13 ' A' ' 15' ' ' ILE 0.415 5.4 ppt_? -145.83 -131.95 0.07 Allowed 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -172.644 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.532 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.425 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.58 1.7 mp -70.33 -60.89 3.02 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.425 ' HD3' HG22 ' A' ' 22' ' ' ILE . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.581 0 C-N-CA 123.662 2.908 . . . . 0.0 118.686 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -126.63 83.04 2.13 Favored 'General case' 0 CA--C 1.559 1.294 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 CA-C-O 118.686 -1.064 . . . . 0.0 112.889 -176.463 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.469 ' H ' HD13 ' A' ' 15' ' ' ILE 0.401 4.8 ppt_? -148.2 -128.14 0.06 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -170.039 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.553 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp -70.39 -60.77 3.06 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -113.72 -26.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.552 1.415 0 C-N-CA 123.633 2.889 . . . . 0.0 118.506 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.82 87.25 2.51 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 CA-C-O 119.254 -0.748 . . . . 0.0 112.439 -175.618 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.474 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 5.8 mt . . . . . 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.532 5.9 ppt_? . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.475 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 6.2 mt . . . . . 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.547 6.3 ppt_? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.48 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.562 5.4 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.428 5.6 ppt_? . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.561 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.556 5.4 mt . . . . . 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.483 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.559 5.7 mt . . . . . 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.548 5.6 mt . . . . . 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.591 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 5.4 mt . . . . . 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 5.9 ppt_? . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.466 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.555 5.8 mt . . . . . 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.9 mt . . . . . 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.564 5.2 mt . . . . . 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.468 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.553 5.6 mt . . . . . 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.476 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.551 2.1 mp . . . . . 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.521 5.8 ppt_? . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.561 5.7 mt . . . . . 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.399 4.7 ppt_? . . . . . 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.533 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.582 1.7 mp . . . . . 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.415 5.4 ppt_? . . . . . 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.532 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.58 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.401 4.8 ppt_? . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.553 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp . . . . . 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 71.4 m . . . . . 0 CA--C 1.551 1.009 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.526 6.2 ppt_? -139.63 -132.28 0.12 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.244 1.942 . . . . 0.0 116.244 -170.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.312 . . -66.35 -63.01 1.17 Allowed 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 121.071 3.73 . . . . 0.0 121.071 -169.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.331 0.0 OUTLIER -72.98 -30.34 63.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 169.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.474 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.0 -44.83 11.94 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.998 0 CA-C-O 118.357 -0.83 . . . . 0.0 111.958 160.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.309 5.5 mptt -71.68 -31.05 66.36 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 168.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -56.2 -56.32 22.4 Favored 'General case' 0 N--CA 1.512 2.659 0 CA-C-N 121.841 2.109 . . . . 0.0 115.446 161.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.293 2.5 pp -57.03 -45.86 84.02 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 CA-C-O 116.766 -1.588 . . . . 0.0 112.926 171.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -70.1 -33.8 72.33 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.635 2.016 . . . . 0.0 115.055 177.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.73 -42.99 26.6 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 159.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.6 -47.05 51.08 Favored 'General case' 0 CA--C 1.594 2.654 0 N-CA-C 117.848 2.536 . . . . 0.0 117.848 162.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 5.8 mt -76.37 -64.01 0.54 Allowed Pre-proline 0 N--CA 1.507 2.389 0 N-CA-C 118.669 2.84 . . . . 0.0 118.669 -169.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HG22 ' A' ' 22' ' ' ILE . 85.4 Cg_endo -129.32 14.98 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.646 0 C-N-CA 123.606 2.871 . . . . 0.0 117.849 175.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.314 0.3 OUTLIER 60.86 59.39 2.1 Favored 'General case' 0 CA--C 1.568 1.658 0 C-N-CA 125.492 1.517 . . . . 0.0 113.716 -177.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.488 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.614 173.398 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.4 p . . . . . 0 CA--C 1.551 0.997 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' H ' ' HB ' ' A' ' 15' ' ' ILE 0.532 5.9 ppt_? -143.48 -128.74 0.09 Allowed 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 116.401 2.0 . . . . 0.0 116.401 -169.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.12 -61.8 1.64 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.102 3.741 . . . . 0.0 121.102 -169.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.52 -31.58 67.22 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 169.335 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.475 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.96 -47.35 16.75 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.776 0 C-N-CA 124.208 1.003 . . . . 0.0 111.951 162.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.314 5.3 mptt -70.9 -30.62 67.02 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 171.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -62.01 -54.93 34.71 Favored 'General case' 0 CA--C 1.588 2.424 0 CA-C-N 121.559 1.982 . . . . 0.0 115.4 162.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.305 2.4 pp -52.34 -46.24 45.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.222 0 CA-C-O 117.137 -1.411 . . . . 0.0 113.249 167.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -69.72 -33.46 72.53 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 121.03 1.741 . . . . 0.0 115.026 176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.4 -43.04 23.21 Favored 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 160.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 23.9 mmt -73.01 -47.11 48.01 Favored 'General case' 0 CA--C 1.592 2.594 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 163.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.473 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 6.2 mt -76.11 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.507 2.408 0 N-CA-C 118.621 2.823 . . . . 0.0 118.621 -169.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HG22 ' A' ' 22' ' ' ILE . 83.0 Cg_endo -129.45 15.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.686 0 C-N-CA 123.57 2.847 . . . . 0.0 117.832 175.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.315 0.3 OUTLIER 61.01 59.76 1.97 Allowed 'General case' 0 CA--C 1.569 1.688 0 C-N-CA 125.536 1.534 . . . . 0.0 113.663 -177.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.523 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.656 173.217 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 82.7 m . . . . . 0 CA--C 1.551 1.001 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.405 ' H ' HD13 ' A' ' 15' ' ' ILE 0.547 6.3 ppt_? -138.25 -131.09 0.13 Allowed 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 -171.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -68.82 -62.12 1.52 Allowed 'General case' 0 CA--C 1.556 1.194 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.61 -31.77 67.26 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 169.509 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.471 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.74 -47.73 15.66 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.791 0 C-N-CA 124.136 0.974 . . . . 0.0 111.834 163.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.34 0.1 OUTLIER -71.45 -30.79 66.44 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 115.816 1.784 . . . . 0.0 115.816 172.743 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.8 tpt180 -61.02 -54.07 49.43 Favored 'General case' 0 CA--C 1.589 2.453 0 CA-C-N 121.33 1.877 . . . . 0.0 115.437 161.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.318 2.3 pp -54.28 -45.16 67.75 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 CA-C-O 116.939 -1.505 . . . . 0.0 113.321 168.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -69.88 -33.29 72.02 Favored 'General case' 0 N--CA 1.5 2.042 0 CA-C-N 121.501 1.955 . . . . 0.0 114.772 175.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -43.49 24.81 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 159.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 mmt -72.81 -46.31 53.86 Favored 'General case' 0 CA--C 1.591 2.535 0 N-CA-C 118.089 2.625 . . . . 0.0 118.089 163.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.464 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.561 5.7 mt -76.19 -63.85 0.57 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.578 2.807 . . . . 0.0 118.578 -169.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.464 ' HD3' HG22 ' A' ' 22' ' ' ILE . 88.8 Cg_endo -129.04 13.22 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.557 0 C-N-CA 123.522 2.815 . . . . 0.0 118.141 175.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.68 57.78 2.61 Favored 'General case' 0 CA--C 1.569 1.697 0 C-N-CA 125.277 1.431 . . . . 0.0 113.755 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.332 0 CA-C-O 118.538 -1.146 . . . . 0.0 110.897 174.599 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 78.4 m . . . . . 0 CA--C 1.551 1.006 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.548 6.5 ppt_? -135.69 -136.4 0.15 Allowed 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 116.44 2.015 . . . . 0.0 116.44 -172.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.314 . . -64.53 -63.32 1.16 Allowed 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 121.196 3.776 . . . . 0.0 121.196 -169.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.334 0.0 OUTLIER -73.04 -30.26 63.59 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 169.677 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -47.89 -45.6 11.85 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.993 0 CA-C-O 118.375 -0.822 . . . . 0.0 111.79 160.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.333 0.2 OUTLIER -72.25 -31.41 65.78 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 116.03 1.863 . . . . 0.0 116.03 170.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 40.6 mmt180 -54.81 -56.25 21.42 Favored 'General case' 0 N--CA 1.512 2.656 0 CA-C-N 121.363 1.892 . . . . 0.0 115.044 159.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.4 pp -58.78 -44.68 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 116.652 -1.642 . . . . 0.0 113.178 172.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -70.12 -33.74 72.21 Favored 'General case' 0 N--CA 1.501 2.118 0 CA-C-N 121.952 2.16 . . . . 0.0 114.677 176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.98 -43.14 29.32 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 114.722 1.378 . . . . 0.0 114.722 159.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 36.2 mmt -72.61 -46.1 55.86 Favored 'General case' 0 CA--C 1.593 2.602 0 N-CA-C 117.995 2.591 . . . . 0.0 117.995 163.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.471 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.562 5.4 mt -76.49 -63.79 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.509 2.781 . . . . 0.0 118.509 -169.642 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.471 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.9 Cg_endo -128.76 13.14 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.558 0 C-N-CA 123.466 2.777 . . . . 0.0 118.145 175.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.303 0.3 OUTLIER 60.77 57.86 2.55 Favored 'General case' 0 CA--C 1.569 1.683 0 C-N-CA 125.264 1.426 . . . . 0.0 113.748 -177.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.306 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 174.599 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' H ' HD13 ' A' ' 15' ' ' ILE 0.428 5.6 ppt_? -145.84 -131.43 0.07 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -171.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.266 . . -64.72 -60.13 3.45 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -169.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.23 -34.7 68.5 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.561 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.3 mp -48.96 -46.81 16.82 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 125.567 1.547 . . . . 0.0 112.69 159.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.354 6.1 mptt -73.61 -31.54 63.6 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 116.829 2.159 . . . . 0.0 116.829 173.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 66.0 mmt-85 -56.74 -56.26 23.73 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 120.91 1.686 . . . . 0.0 114.291 163.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.254 2.6 pp -58.72 -47.56 88.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 CA-C-O 116.259 -1.829 . . . . 0.0 113.044 171.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -65.92 -34.68 78.67 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 122.224 2.284 . . . . 0.0 115.466 176.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.82 -44.05 28.49 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 114.541 1.312 . . . . 0.0 114.541 161.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -72.84 -46.59 52.22 Favored 'General case' 0 CA--C 1.597 2.769 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 162.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.483 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.556 5.4 mt -75.13 -63.81 0.67 Allowed Pre-proline 0 N--CA 1.508 2.457 0 N-CA-C 119.309 3.078 . . . . 0.0 119.309 -169.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.483 ' HD3' HG22 ' A' ' 22' ' ' ILE . 89.5 Cg_endo -129.17 4.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.584 0 C-N-CA 123.512 2.808 . . . . 0.0 117.931 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.406 0.2 OUTLIER 76.92 -71.73 0.11 Allowed 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.915 1.686 . . . . 0.0 112.385 -179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 CA-C-O 118.849 -0.973 . . . . 0.0 111.776 170.726 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.1 t . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.537 5.8 ppt_? -144.22 -132.4 0.08 Allowed 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -172.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.296 . . -68.74 -60.92 2.06 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 121.442 3.867 . . . . 0.0 121.442 -169.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.267 0.0 OUTLIER -70.95 -31.62 68.25 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 112.918 0.711 . . . . 0.0 112.918 169.223 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.483 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.06 -46.58 17.3 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.748 0 C-N-CA 124.176 0.99 . . . . 0.0 111.976 162.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.355 4.2 mmtp -71.17 -30.86 66.95 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 116.508 2.04 . . . . 0.0 116.508 170.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -61.97 -53.49 54.86 Favored 'General case' 0 CA--C 1.589 2.446 0 CA-C-N 121.495 1.952 . . . . 0.0 115.278 163.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.307 2.3 pp -53.46 -45.92 58.48 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-O 116.875 -1.536 . . . . 0.0 113.248 167.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -69.72 -33.27 72.26 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 121.512 1.96 . . . . 0.0 114.908 176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.63 -43.47 26.03 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 160.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.3 mmt -72.93 -46.29 53.35 Favored 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 118.053 2.612 . . . . 0.0 118.053 163.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.463 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.559 5.7 mt -76.19 -63.96 0.56 Allowed Pre-proline 0 N--CA 1.506 2.374 0 N-CA-C 118.6 2.815 . . . . 0.0 118.6 -169.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.463 ' HD3' HG22 ' A' ' 22' ' ' ILE . 91.3 Cg_endo -128.74 13.7 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.568 0 C-N-CA 123.425 2.75 . . . . 0.0 118.052 175.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.307 0.3 OUTLIER 61.28 58.53 2.15 Favored 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.239 1.415 . . . . 0.0 113.579 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 110.717 -0.953 . . . . 0.0 110.717 174.448 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 74.5 m . . . . . 0 N--CA 1.479 1.008 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.441 6.3 ppt_? -139.04 -139.25 0.14 Allowed 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.274 . . -60.51 -58.69 7.42 Favored 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 -169.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -71.17 -38.36 72.16 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.202 -0.908 . . . . 0.0 113.058 178.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.555 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -49.04 -51.46 12.73 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.665 0 C-N-CA 126.045 1.738 . . . . 0.0 112.887 162.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.405 31.7 mmtt -72.43 -30.89 65.03 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 176.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.1 mpt_? -61.23 -52.39 64.95 Favored 'General case' 0 N--CA 1.505 2.316 0 CA-C-N 121.074 1.761 . . . . 0.0 114.769 162.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.299 2.7 pp -56.79 -46.45 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 CA-C-O 116.589 -1.672 . . . . 0.0 113.056 169.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -67.81 -34.53 76.93 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 121.869 2.122 . . . . 0.0 115.032 175.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.44 -43.36 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 161.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.9 mmt -72.82 -47.94 42.08 Favored 'General case' 0 CA--C 1.594 2.658 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 162.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.497 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.548 5.6 mt -74.69 -63.68 0.75 Allowed Pre-proline 0 N--CA 1.509 2.48 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 -169.504 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.497 ' HD3' HG22 ' A' ' 22' ' ' ILE . 87.7 Cg_endo -129.18 3.91 0.0 OUTLIER 'Trans proline' 0 CA--C 1.571 2.345 0 C-N-CA 123.589 2.859 . . . . 0.0 118.357 175.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.425 0.0 OUTLIER 46.93 56.95 6.1 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 179.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.223 0 N-CA-C 109.513 -1.435 . . . . 0.0 109.513 175.983 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 CA--C 1.551 1.016 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.416 ' H ' HD13 ' A' ' 15' ' ' ILE 0.591 0.0 OUTLIER -138.39 -131.67 0.13 Allowed 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -172.675 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.297 . . -70.24 -61.54 1.73 Allowed 'General case' 0 CA--C 1.557 1.242 0 N-CA-C 121.255 3.798 . . . . 0.0 121.255 -169.41 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.276 0.0 OUTLIER -71.24 -31.12 67.16 Favored 'General case' 0 N--CA 1.481 1.075 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.999 168.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.486 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.75 -49.86 14.11 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.78 0 C-N-CA 124.073 0.949 . . . . 0.0 111.78 162.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.332 0.2 OUTLIER -70.94 -30.6 66.96 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 173.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.13 -52.65 58.08 Favored 'General case' 0 CA--C 1.59 2.517 0 CA-C-N 121.032 1.742 . . . . 0.0 114.693 162.336 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.331 2.3 pp -52.97 -44.71 50.63 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.474 0 O-C-N 119.793 -1.817 . . . . 0.0 113.391 167.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -68.72 -32.76 72.77 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-N 121.082 1.764 . . . . 0.0 114.796 174.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.31 -44.62 23.64 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 160.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.7 -46.03 55.78 Favored 'General case' 0 CA--C 1.59 2.489 0 N-CA-C 118.506 2.78 . . . . 0.0 118.506 162.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.443 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.566 5.4 mt -75.9 -63.82 0.6 Allowed Pre-proline 0 N--CA 1.507 2.385 0 N-CA-C 118.631 2.826 . . . . 0.0 118.631 -169.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.443 ' HD3' HG22 ' A' ' 22' ' ' ILE . 84.6 Cg_endo -129.51 12.73 0.0 OUTLIER 'Trans proline' 0 CA--C 1.575 2.562 0 C-N-CA 123.505 2.803 . . . . 0.0 118.148 175.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.299 0.4 OUTLIER 60.23 57.36 2.95 Favored 'General case' 0 CA--C 1.57 1.714 0 C-N-CA 125.311 1.445 . . . . 0.0 113.853 -177.483 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.324 0 CA-C-O 118.658 -1.079 . . . . 0.0 110.995 174.806 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.7 m . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.435 ' H ' HD13 ' A' ' 15' ' ' ILE 0.526 5.9 ppt_? -141.75 -128.05 0.1 Allowed 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -170.009 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.293 . . -70.0 -61.74 1.66 Allowed 'General case' 0 CA--C 1.556 1.206 0 N-CA-C 121.111 3.745 . . . . 0.0 121.111 -169.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.271 0.0 OUTLIER -71.39 -31.87 67.79 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 169.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.466 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.0 mp -48.84 -47.44 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.77 0 C-N-CA 124.286 1.035 . . . . 0.0 111.956 163.123 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.342 4.2 mptt -71.54 -30.41 65.87 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 116.18 1.919 . . . . 0.0 116.18 171.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.1 tpt180 -61.4 -53.91 50.41 Favored 'General case' 0 CA--C 1.59 2.499 0 CA-C-N 121.421 1.919 . . . . 0.0 115.311 162.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.316 2.3 pp -53.77 -44.85 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.2 0 CA-C-O 116.971 -1.49 . . . . 0.0 113.321 167.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -69.12 -34.01 74.37 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 121.43 1.923 . . . . 0.0 114.912 175.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.61 -42.78 24.87 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 160.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 84.1 mmm -72.74 -46.53 53.06 Favored 'General case' 0 CA--C 1.591 2.555 0 N-CA-C 118.04 2.607 . . . . 0.0 118.04 162.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.476 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.555 5.8 mt -76.55 -64.04 0.52 Allowed Pre-proline 0 N--CA 1.507 2.402 0 N-CA-C 118.467 2.765 . . . . 0.0 118.467 -169.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.476 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.9 Cg_endo -127.97 18.47 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.679 0 C-N-CA 123.629 2.886 . . . . 0.0 117.592 174.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.329 0.1 OUTLIER 63.8 60.93 1.01 Allowed 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.61 1.564 . . . . 0.0 113.369 -179.665 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.444 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.005 170.949 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.1 p . . . . . 0 CA--C 1.551 0.988 0 N-CA-C 110.445 -0.205 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.567 6.6 ppt_? -136.99 -133.51 0.14 Allowed 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -173.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.298 . . -68.11 -62.08 1.57 Allowed 'General case' 0 CA--C 1.556 1.184 0 N-CA-C 121.349 3.833 . . . . 0.0 121.349 -169.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.266 0.0 OUTLIER -71.55 -31.96 67.58 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 169.408 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.453 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.7 mp -48.78 -48.23 15.62 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.772 0 C-N-CA 124.223 1.009 . . . . 0.0 111.864 163.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.326 0.0 OUTLIER -71.44 -30.23 65.8 Favored 'General case' 0 N--CA 1.489 1.507 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 172.272 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -60.87 -53.67 54.49 Favored 'General case' 0 CA--C 1.59 2.505 0 CA-C-N 121.487 1.949 . . . . 0.0 115.262 161.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.33 2.3 pp -54.19 -43.86 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.178 0 CA-C-O 116.791 -1.575 . . . . 0.0 113.419 167.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -69.23 -34.41 74.8 Favored 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 121.653 2.024 . . . . 0.0 114.93 174.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.52 -42.33 23.0 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 114.657 1.354 . . . . 0.0 114.657 161.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.1 mmt -72.83 -47.13 48.88 Favored 'General case' 0 CA--C 1.593 2.61 0 N-CA-C 117.99 2.589 . . . . 0.0 117.99 161.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.484 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.553 5.9 mt -76.17 -64.11 0.55 Allowed Pre-proline 0 N--CA 1.508 2.445 0 N-CA-C 118.573 2.805 . . . . 0.0 118.573 -169.579 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.484 ' HD3' HG22 ' A' ' 22' ' ' ILE . 84.8 Cg_endo -129.15 17.38 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.718 0 C-N-CA 123.763 2.975 . . . . 0.0 117.67 174.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.319 0.2 OUTLIER 61.06 60.5 1.79 Allowed 'General case' 0 CA--C 1.568 1.638 0 C-N-CA 125.552 1.541 . . . . 0.0 113.675 -177.813 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.512 0 CA-C-O 118.659 -1.079 . . . . 0.0 111.905 172.821 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m . . . . . 0 CA--C 1.552 1.021 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.551 6.6 ppt_? -135.02 -137.35 0.16 Allowed 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 116.396 1.999 . . . . 0.0 116.396 -172.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -63.82 -63.32 1.2 Allowed 'General case' 0 CA--C 1.557 1.225 0 N-CA-C 121.314 3.82 . . . . 0.0 121.314 -169.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.329 0.0 OUTLIER -72.81 -30.44 64.06 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 169.725 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.462 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -47.83 -46.3 11.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.0 0 CA-C-O 118.385 -0.817 . . . . 0.0 111.776 161.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.317 0.2 OUTLIER -71.96 -31.2 66.07 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 116.203 1.927 . . . . 0.0 116.203 170.312 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 41.0 mmt180 -54.56 -55.82 25.28 Favored 'General case' 0 N--CA 1.512 2.651 0 CA-C-N 121.418 1.917 . . . . 0.0 114.722 159.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.324 2.3 pp -58.77 -43.22 87.49 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 CA-C-O 116.295 -1.812 . . . . 0.0 113.339 171.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.21 -34.15 72.56 Favored 'General case' 0 N--CA 1.502 2.15 0 CA-C-N 122.455 2.388 . . . . 0.0 114.863 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.75 -42.53 25.74 Favored 'General case' 0 N--CA 1.499 2.022 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 160.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.7 mmt -72.55 -46.4 54.63 Favored 'General case' 0 CA--C 1.593 2.605 0 N-CA-C 118.035 2.606 . . . . 0.0 118.035 162.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.479 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.564 5.2 mt -76.5 -63.69 0.55 Allowed Pre-proline 0 N--CA 1.507 2.383 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -169.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.479 ' HD3' HG22 ' A' ' 22' ' ' ILE . 93.6 Cg_endo -128.88 13.74 0.0 OUTLIER 'Trans proline' 0 CA--C 1.576 2.625 0 C-N-CA 123.496 2.797 . . . . 0.0 118.001 175.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.305 0.3 OUTLIER 60.64 58.17 2.52 Favored 'General case' 0 CA--C 1.569 1.692 0 C-N-CA 125.317 1.447 . . . . 0.0 113.763 -178.079 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.296 0 N-CA-C 111.086 -0.805 . . . . 0.0 111.086 174.191 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.5 t . . . . . 0 CA--C 1.551 1.003 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.531 6.3 ppt_? -141.86 -132.91 0.1 Allowed 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 -169.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.311 . . -66.17 -62.84 1.27 Allowed 'General case' 0 CA--C 1.557 1.241 0 N-CA-C 121.24 3.793 . . . . 0.0 121.24 -169.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.323 0.0 OUTLIER -72.68 -30.41 64.23 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 169.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.468 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -48.0 -45.38 12.22 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.053 0 CA-C-O 118.311 -0.852 . . . . 0.0 111.808 161.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER -71.89 -30.69 65.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 116.379 1.992 . . . . 0.0 116.379 169.1 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -55.37 -56.01 25.0 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 121.677 2.035 . . . . 0.0 115.266 159.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.313 2.4 pp -57.71 -44.01 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 CA-C-O 116.463 -1.732 . . . . 0.0 113.165 171.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -69.82 -34.45 73.7 Favored 'General case' 0 N--CA 1.499 2.009 0 CA-C-N 122.037 2.199 . . . . 0.0 114.988 175.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.66 -42.13 23.93 Favored 'General case' 0 N--CA 1.499 2.021 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 160.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.8 mmt -72.81 -47.1 49.27 Favored 'General case' 0 CA--C 1.595 2.675 0 N-CA-C 117.826 2.528 . . . . 0.0 117.826 162.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.483 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.553 5.6 mt -76.43 -63.96 0.54 Allowed Pre-proline 0 N--CA 1.508 2.437 0 N-CA-C 118.635 2.828 . . . . 0.0 118.635 -169.618 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.483 ' HD3' HG22 ' A' ' 22' ' ' ILE . 89.1 Cg_endo -128.95 16.55 0.0 OUTLIER 'Trans proline' 0 CA--C 1.577 2.631 0 C-N-CA 123.642 2.895 . . . . 0.0 117.679 175.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.316 0.2 OUTLIER 61.16 60.09 1.85 Allowed 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 125.563 1.545 . . . . 0.0 113.651 -177.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.474 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.632 172.893 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.8 p . . . . . 0 CA--C 1.551 1.014 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . 0.54 6.4 ppt_? -141.09 -134.76 0.11 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 116.234 1.939 . . . . 0.0 116.234 -172.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.313 . . -65.79 -62.9 1.24 Allowed 'General case' 0 CA--C 1.557 1.23 0 N-CA-C 121.041 3.719 . . . . 0.0 121.041 -169.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.337 0.0 OUTLIER -72.66 -30.53 64.36 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 169.571 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.476 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.2 mp -48.12 -44.88 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.578 2.022 0 CA-C-O 118.278 -0.867 . . . . 0.0 111.99 160.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.339 4.7 mptt -72.32 -30.9 65.2 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 116.524 2.046 . . . . 0.0 116.524 169.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 87.8 mmt-85 -55.62 -56.24 22.68 Favored 'General case' 0 N--CA 1.513 2.713 0 CA-C-N 121.447 1.93 . . . . 0.0 114.946 160.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.309 2.5 pp -57.46 -45.71 85.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 CA-C-O 116.162 -1.875 . . . . 0.0 112.943 170.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -69.6 -33.63 72.96 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 122.184 2.265 . . . . 0.0 115.156 177.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.39 -43.52 23.57 Favored 'General case' 0 N--CA 1.499 1.99 0 N-CA-C 114.556 1.317 . . . . 0.0 114.556 160.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.4 mmt -73.18 -43.71 61.0 Favored 'General case' 0 CA--C 1.6 2.889 0 N-CA-C 118.703 2.853 . . . . 0.0 118.703 160.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.52 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.551 2.1 mp -76.51 -63.48 0.57 Allowed Pre-proline 0 N--CA 1.51 2.574 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 -169.802 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.52 ' HD3' HG22 ' A' ' 22' ' ' ILE . 85.7 Cg_endo -129.03 17.9 0.0 OUTLIER 'Trans proline' 0 CA--C 1.578 2.703 0 C-N-CA 123.828 3.019 . . . . 0.0 117.631 174.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.337 0.1 OUTLIER 64.28 60.54 0.95 Allowed 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 125.743 1.617 . . . . 0.0 113.355 -179.334 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.418 0 CA-C-O 118.487 -1.174 . . . . 0.0 111.637 170.854 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 CA--C 1.551 0.996 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.449 ' H ' HD13 ' A' ' 15' ' ' ILE 0.521 5.8 ppt_? -142.0 -127.7 0.1 Allowed 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 116.382 1.993 . . . . 0.0 116.382 -169.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.295 . . -70.18 -61.74 1.66 Allowed 'General case' 0 CA--C 1.557 1.223 0 N-CA-C 121.295 3.813 . . . . 0.0 121.295 -169.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.274 0.0 OUTLIER -71.38 -31.47 67.34 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-O 118.397 -0.811 . . . . 0.0 112.949 168.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.465 HD12 ' H ' ' A' ' 15' ' ' ILE . 5.1 mp -49.09 -48.77 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.775 0 C-N-CA 124.121 0.968 . . . . 0.0 112.02 162.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.336 4.2 mptt -71.19 -30.34 66.27 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 116.288 1.959 . . . . 0.0 116.288 172.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 0.0 OUTLIER -64.66 -52.49 57.05 Favored 'General case' 0 CA--C 1.59 2.508 0 CA-C-N 121.263 1.847 . . . . 0.0 114.633 163.126 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.325 2.3 pp -52.15 -45.38 42.4 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.493 0 O-C-N 119.874 -1.766 . . . . 0.0 113.258 167.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -67.58 -32.91 73.97 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 120.922 1.692 . . . . 0.0 115.419 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.49 -44.33 25.24 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 162.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.8 mmt -73.05 -46.47 51.61 Favored 'General case' 0 CA--C 1.591 2.532 0 N-CA-C 118.677 2.843 . . . . 0.0 118.677 161.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.437 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.561 5.7 mt -76.0 -64.39 0.53 Allowed Pre-proline 0 N--CA 1.508 2.456 0 N-CA-C 119.302 3.075 . . . . 0.0 119.302 -169.532 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.437 ' HD3' HG22 ' A' ' 22' ' ' ILE . 90.1 Cg_endo -130.43 23.26 0.0 OUTLIER 'Trans proline' 0 CA--C 1.574 2.503 0 C-N-CA 123.64 2.893 . . . . 0.0 118.149 177.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . 0.331 0.0 OUTLIER 80.62 52.21 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 125.759 1.623 . . . . 0.0 113.148 168.476 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 CA-C-O 119.37 -0.683 . . . . 0.0 112.843 177.056 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.8 m . . . . . 0 CA--C 1.552 1.019 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.462 ' H ' HD13 ' A' ' 15' ' ' ILE 0.399 4.7 ppt_? -148.23 -128.12 0.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 113.526 0.935 . . . . 0.0 113.526 -170.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.271 . . -64.16 -58.39 6.76 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 118.674 2.842 . . . . 0.0 118.674 -169.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.32 -37.67 71.75 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 114.59 -1.186 . . . . 0.0 112.969 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.533 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.54 -53.06 10.43 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.901 0 C-N-CA 126.835 2.054 . . . . 0.0 113.089 162.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.291 4.3 mptt -73.21 -32.18 64.62 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 117.319 2.34 . . . . 0.0 117.319 178.228 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.4 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -65.06 -43.89 90.82 Favored 'General case' 0 CA--C 1.581 2.156 0 CA-C-N 120.59 1.541 . . . . 0.0 113.901 162.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.39 2.7 pp -58.89 -46.64 91.11 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 CA-C-O 115.429 -2.224 . . . . 0.0 112.152 168.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.279 12.7 mt-30 -63.55 -32.56 74.05 Favored 'General case' 0 N--CA 1.503 2.194 0 CA-C-N 123.153 2.706 . . . . 0.0 115.728 170.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.42 -46.68 26.62 Favored 'General case' 0 CA--C 1.58 2.102 0 O-C-N 120.782 -1.198 . . . . 0.0 113.647 163.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.51 -37.06 60.39 Favored 'General case' 0 CA--C 1.602 2.942 0 N-CA-C 121.206 3.78 . . . . 0.0 121.206 161.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.427 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.582 1.7 mp -70.35 -60.89 3.02 Favored Pre-proline 0 N--CA 1.512 2.669 0 N-CA-C 119.435 3.124 . . . . 0.0 119.435 -169.38 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.427 ' HD3' HG22 ' A' ' 22' ' ' ILE . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.61 0 C-N-CA 123.701 2.934 . . . . 0.0 118.68 176.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -126.82 82.93 2.12 Favored 'General case' 0 CA--C 1.559 1.292 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 CA-C-O 119.393 -0.67 . . . . 0.0 112.863 -176.334 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 CA--C 1.552 1.033 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.423 ' H ' HD13 ' A' ' 15' ' ' ILE 0.415 5.4 ppt_? -145.83 -131.95 0.07 Allowed 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 113.977 1.103 . . . . 0.0 113.977 -172.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.27 . . -62.79 -58.74 6.37 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 118.79 2.885 . . . . 0.0 118.79 -169.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -71.38 -37.7 71.56 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.96 179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.532 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.8 mp -49.43 -53.48 8.95 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.899 0 C-N-CA 126.737 2.015 . . . . 0.0 112.947 162.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.281 0.0 OUTLIER -73.21 -32.34 64.72 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 117.022 2.23 . . . . 0.0 117.022 179.343 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 20' ' ' ALA . 4.1 tmt_? -64.68 -44.05 91.55 Favored 'General case' 0 CA--C 1.581 2.151 0 CA-C-N 120.471 1.487 . . . . 0.0 113.936 162.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.397 2.7 pp -58.99 -46.68 91.46 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 CA-C-O 115.516 -2.183 . . . . 0.0 112.195 168.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.272 13.9 mt-30 -63.54 -32.5 73.98 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-N 123.062 2.665 . . . . 0.0 115.647 170.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 17' ' ' ARG . . . -47.48 -46.77 27.37 Favored 'General case' 0 CA--C 1.579 2.083 0 O-C-N 120.798 -1.189 . . . . 0.0 113.676 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 92.0 mmm -75.42 -37.24 60.55 Favored 'General case' 0 CA--C 1.601 2.941 0 N-CA-C 121.236 3.791 . . . . 0.0 121.236 161.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.425 HG22 ' HD3' ' A' ' 23' ' ' PRO 0.58 1.7 mp -70.33 -60.89 3.02 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.406 3.113 . . . . 0.0 119.406 -169.338 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.425 ' HD3' HG22 ' A' ' 22' ' ' ILE . 56.8 Cg_endo -118.11 -10.22 0.02 OUTLIER 'Trans proline' 0 CA--C 1.556 1.581 0 C-N-CA 123.662 2.908 . . . . 0.0 118.686 176.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -126.63 83.04 2.13 Favored 'General case' 0 CA--C 1.559 1.294 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 CA-C-O 118.686 -1.064 . . . . 0.0 112.889 -176.463 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 72.8 m . . . . . 0 CA--C 1.551 1.019 0 N-CA-C 109.435 -0.579 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.469 ' H ' HD13 ' A' ' 15' ' ' ILE 0.401 4.8 ppt_? -148.2 -128.14 0.06 Allowed 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -170.039 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . 0.265 . . -64.72 -58.36 6.49 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 118.404 2.742 . . . . 0.0 118.404 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -70.82 -38.33 73.25 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 114.95 -1.023 . . . . 0.0 113.171 179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.553 HD12 ' H ' ' A' ' 15' ' ' ILE . 4.9 mp -48.71 -50.39 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.573 1.84 0 C-N-CA 126.597 1.959 . . . . 0.0 112.978 162.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . 0.312 5.1 mptt -73.72 -32.38 63.86 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 10.0 mpt_? -60.52 -49.34 77.95 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 120.826 1.648 . . . . 0.0 114.734 162.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . 0.359 2.7 pp -57.36 -52.58 55.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-O 115.12 -2.371 . . . . 0.0 112.188 168.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . 0.283 18.5 mt-30 -62.53 -32.85 73.86 Favored 'General case' 0 N--CA 1.506 2.365 0 CA-C-N 123.8 3.0 . . . . 0.0 115.986 175.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -47.92 -47.56 32.26 Favored 'General case' 0 CA--C 1.579 2.089 0 O-C-N 120.687 -1.258 . . . . 0.0 113.907 163.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 26.5 mmt -75.42 -36.5 60.8 Favored 'General case' 0 CA--C 1.601 2.939 0 N-CA-C 121.34 3.83 . . . . 0.0 121.34 162.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . 0.566 1.7 mp -70.39 -60.77 3.06 Favored Pre-proline 0 N--CA 1.511 2.61 0 N-CA-C 119.31 3.078 . . . . 0.0 119.31 -169.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -113.72 -26.35 0.01 OUTLIER 'Trans proline' 0 CA--C 1.552 1.415 0 C-N-CA 123.633 2.889 . . . . 0.0 118.506 177.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.82 87.25 2.51 Favored 'General case' 0 CA--C 1.559 1.316 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.6 0 CA-C-O 119.254 -0.748 . . . . 0.0 112.439 -175.618 . . . . . . . . 0 0 . 1 stop_ save_