data_2jqc_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 2jqc _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 . . . . . 0 CA--C 1.538 0.492 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 . . . . . 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 . . . . . 0 CA--C 1.533 0.306 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 122.396 1.093 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? . . . . . 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 CA--C 1.535 0.403 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 . . . . . 0 CA--C 1.535 0.368 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 . . . . . 0 CA--C 1.535 0.399 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 . . . . . 0 CA--C 1.537 0.476 0 CA-C-O 122.299 1.047 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 121.639 0.733 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -144.33 126.98 16.1 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.918 1.287 . . . . 0.0 108.013 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.4 175.9 5.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.54 1.136 . . . . 0.0 111.106 168.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -70.04 134.14 47.95 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.526 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -76.61 123.24 25.81 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.11 -29.19 65.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.432 1.093 . . . . 0.0 112.164 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -82.38 59.05 4.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 110.945 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.87 178.2 3.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.924 1.29 . . . . 0.0 111.459 174.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -64.15 136.83 57.59 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.212 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -75.78 131.06 39.54 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -56.64 -33.08 65.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.422 1.089 . . . . 0.0 112.344 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -155.22 113.97 3.55 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 108.056 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -81.71 -179.1 7.25 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 125.721 1.608 . . . . 0.0 111.195 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -71.65 110.35 6.15 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 167.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -75.43 131.4 40.14 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -55.94 -32.33 63.74 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.608 1.163 . . . . 0.0 112.35 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -78.82 67.92 4.66 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.375 1.07 . . . . 0.0 110.699 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -68.59 176.56 2.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.213 170.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.95 111.07 5.39 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.425 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -72.28 127.78 33.61 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.25 -33.14 62.9 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.674 1.189 . . . . 0.0 112.093 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -78.76 76.35 5.26 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.81 174.8 6.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.82 1.248 . . . . 0.0 111.112 171.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -69.67 124.48 24.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.449 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -76.08 129.23 36.49 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -57.63 -26.1 61.1 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.591 1.156 . . . . 0.0 112.498 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.6 t70 . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 67.8 t90 -79.82 94.98 5.9 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.84 170.61 5.17 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.393 1.077 . . . . 0.0 111.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -62.42 134.62 56.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.245 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -74.6 125.42 28.62 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.69 -23.6 59.76 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.568 1.147 . . . . 0.0 112.543 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 6.4 m-90 -80.55 61.35 4.24 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.486 1.114 . . . . 0.0 110.946 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.13 175.91 4.21 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.377 173.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -70.47 112.85 7.06 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.947 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.4 134.54 42.42 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -56.47 -28.54 59.98 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.597 1.159 . . . . 0.0 112.362 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -141.28 41.39 1.77 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.621 1.168 . . . . 0.0 110.758 -172.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -64.2 172.01 2.69 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.119 0.961 . . . . 0.0 111.814 172.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -65.93 130.51 43.5 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.868 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -74.56 127.89 34.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -55.89 -31.52 62.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.616 1.166 . . . . 0.0 112.235 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -77.86 88.39 4.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.85 177.28 2.64 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.767 1.227 . . . . 0.0 111.005 168.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -66.52 114.89 5.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.273 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -73.3 128.81 36.55 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -56.68 -31.56 64.57 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.476 1.11 . . . . 0.0 112.298 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -79.67 70.73 6.23 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 109.568 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.02 175.28 6.81 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.043 1.337 . . . . 0.0 111.421 174.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.19 129.92 41.37 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.662 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.62 131.26 40.78 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.29 -30.86 65.06 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.377 1.071 . . . . 0.0 112.295 -177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 122.435 1.112 . . . . 0.0 109.896 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -84.93 64.75 8.84 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.348 1.059 . . . . 0.0 110.62 -173.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.05 170.9 6.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.229 1.011 . . . . 0.0 111.619 172.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -69.92 121.46 17.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.625 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -73.9 129.39 37.79 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -56.26 -30.36 62.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 112.398 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 122.266 1.032 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -83.63 77.58 9.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.032 0.933 . . . . 0.0 110.248 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.27 175.49 3.26 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.096 0.958 . . . . 0.0 111.076 167.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -70.89 110.33 5.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.989 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -77.23 135.3 38.47 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -57.17 -28.09 62.5 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.385 1.074 . . . . 0.0 112.427 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -79.0 64.46 3.93 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.671 1.188 . . . . 0.0 110.376 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.02 175.99 5.45 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 125.334 1.454 . . . . 0.0 112.083 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -77.37 61.73 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.855 1.662 . . . . 0.0 110.081 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -71.63 135.37 46.9 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -54.54 -31.71 56.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.874 1.27 . . . . 0.0 112.352 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -79.18 69.84 5.45 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.27 1.028 . . . . 0.0 110.391 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.1 179.5 2.32 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.043 1.337 . . . . 0.0 111.369 172.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.62 134.13 54.92 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.446 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -74.84 132.4 41.49 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -55.86 -30.23 61.16 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.626 1.171 . . . . 0.0 112.479 -178.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -77.71 88.03 3.97 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.66 176.68 3.98 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.813 1.245 . . . . 0.0 111.211 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -65.12 127.06 30.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.885 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -74.92 128.33 35.31 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.86 -28.95 64.61 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.369 1.068 . . . . 0.0 112.187 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -79.02 72.08 5.53 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.27 1.028 . . . . 0.0 110.256 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.67 171.61 6.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.904 1.281 . . . . 0.0 111.751 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.64 131.63 45.53 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.261 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -75.34 117.76 17.49 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -57.25 -26.35 60.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.321 1.049 . . . . 0.0 112.09 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -77.7 80.26 4.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.782 0.833 . . . . 0.0 110.146 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.92 -179.95 1.63 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.955 1.302 . . . . 0.0 111.114 168.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.56 132.52 52.7 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.011 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -70.03 119.14 13.79 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -57.93 -24.75 59.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.269 1.428 . . . . 0.0 112.958 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.8 t90 -77.63 84.37 3.99 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -74.13 170.06 16.27 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.736 1.214 . . . . 0.0 112.066 -178.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -78.18 63.2 3.06 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.181 1.392 . . . . 0.0 109.45 173.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -72.39 134.4 45.41 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.95 -32.19 61.16 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.606 1.162 . . . . 0.0 112.589 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.1 m-90 -79.34 69.51 5.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.19 0.996 . . . . 0.0 110.499 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -67.82 175.54 2.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.778 1.231 . . . . 0.0 111.326 171.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -66.79 125.86 27.2 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.809 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -70.85 128.16 35.07 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.51 -25.85 67.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.017 0.927 . . . . 0.0 112.176 -177.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -78.49 76.53 4.99 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.985 0.914 . . . . 0.0 109.672 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.85 176.85 3.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.208 1.403 . . . . 0.0 111.688 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -76.83 74.29 3.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.448 1.099 . . . . 0.0 109.317 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -73.6 128.59 35.91 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -57.3 -30.57 64.84 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 112.26 -179.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 . . . . . 0 CA--C 1.538 0.492 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 . . . . . 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 . . . . . 0 CA--C 1.533 0.306 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 122.396 1.093 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? . . . . . 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 CA--C 1.535 0.403 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 . . . . . 0 CA--C 1.535 0.368 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 . . . . . 0 CA--C 1.535 0.399 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 . . . . . 0 CA--C 1.537 0.476 0 CA-C-O 122.299 1.047 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 121.639 0.733 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -144.33 126.98 16.1 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.918 1.287 . . . . 0.0 108.013 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.4 175.9 5.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.54 1.136 . . . . 0.0 111.106 168.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -70.04 134.14 47.95 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.526 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -76.61 123.24 25.81 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.11 -29.19 65.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.432 1.093 . . . . 0.0 112.164 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -82.38 59.05 4.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 110.945 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.87 178.2 3.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.924 1.29 . . . . 0.0 111.459 174.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -64.15 136.83 57.59 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.212 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -75.78 131.06 39.54 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -56.64 -33.08 65.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.422 1.089 . . . . 0.0 112.344 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -155.22 113.97 3.55 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 108.056 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -81.71 -179.1 7.25 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 125.721 1.608 . . . . 0.0 111.195 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -71.65 110.35 6.15 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 167.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -75.43 131.4 40.14 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -55.94 -32.33 63.74 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.608 1.163 . . . . 0.0 112.35 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -78.82 67.92 4.66 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.375 1.07 . . . . 0.0 110.699 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -68.59 176.56 2.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.213 170.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.95 111.07 5.39 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.425 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -72.28 127.78 33.61 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.25 -33.14 62.9 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.674 1.189 . . . . 0.0 112.093 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -78.76 76.35 5.26 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.81 174.8 6.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.82 1.248 . . . . 0.0 111.112 171.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -69.67 124.48 24.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.449 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -76.08 129.23 36.49 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -57.63 -26.1 61.1 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.591 1.156 . . . . 0.0 112.498 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.6 t70 . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 67.8 t90 -79.82 94.98 5.9 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.84 170.61 5.17 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.393 1.077 . . . . 0.0 111.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -62.42 134.62 56.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.245 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -74.6 125.42 28.62 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.69 -23.6 59.76 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.568 1.147 . . . . 0.0 112.543 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 6.4 m-90 -80.55 61.35 4.24 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.486 1.114 . . . . 0.0 110.946 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.13 175.91 4.21 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.377 173.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -70.47 112.85 7.06 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.947 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.4 134.54 42.42 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -56.47 -28.54 59.98 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.597 1.159 . . . . 0.0 112.362 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -141.28 41.39 1.77 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.621 1.168 . . . . 0.0 110.758 -172.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -64.2 172.01 2.69 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.119 0.961 . . . . 0.0 111.814 172.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -65.93 130.51 43.5 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.868 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -74.56 127.89 34.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -55.89 -31.52 62.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.616 1.166 . . . . 0.0 112.235 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -77.86 88.39 4.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.85 177.28 2.64 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.767 1.227 . . . . 0.0 111.005 168.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -66.52 114.89 5.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.273 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -73.3 128.81 36.55 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -56.68 -31.56 64.57 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.476 1.11 . . . . 0.0 112.298 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -79.67 70.73 6.23 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 109.568 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.02 175.28 6.81 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.043 1.337 . . . . 0.0 111.421 174.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.19 129.92 41.37 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.662 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.62 131.26 40.78 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.29 -30.86 65.06 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.377 1.071 . . . . 0.0 112.295 -177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 122.435 1.112 . . . . 0.0 109.896 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -84.93 64.75 8.84 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.348 1.059 . . . . 0.0 110.62 -173.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.05 170.9 6.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.229 1.011 . . . . 0.0 111.619 172.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -69.92 121.46 17.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.625 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -73.9 129.39 37.79 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -56.26 -30.36 62.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 112.398 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 122.266 1.032 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -83.63 77.58 9.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.032 0.933 . . . . 0.0 110.248 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.27 175.49 3.26 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.096 0.958 . . . . 0.0 111.076 167.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -70.89 110.33 5.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.989 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -77.23 135.3 38.47 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -57.17 -28.09 62.5 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.385 1.074 . . . . 0.0 112.427 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -79.0 64.46 3.93 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.671 1.188 . . . . 0.0 110.376 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.02 175.99 5.45 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 125.334 1.454 . . . . 0.0 112.083 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -77.37 61.73 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.855 1.662 . . . . 0.0 110.081 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -71.63 135.37 46.9 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -54.54 -31.71 56.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.874 1.27 . . . . 0.0 112.352 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -79.18 69.84 5.45 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.27 1.028 . . . . 0.0 110.391 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.1 179.5 2.32 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.043 1.337 . . . . 0.0 111.369 172.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.62 134.13 54.92 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.446 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -74.84 132.4 41.49 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -55.86 -30.23 61.16 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.626 1.171 . . . . 0.0 112.479 -178.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -77.71 88.03 3.97 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.66 176.68 3.98 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.813 1.245 . . . . 0.0 111.211 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -65.12 127.06 30.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.885 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -74.92 128.33 35.31 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.86 -28.95 64.61 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.369 1.068 . . . . 0.0 112.187 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -79.02 72.08 5.53 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.27 1.028 . . . . 0.0 110.256 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.67 171.61 6.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.904 1.281 . . . . 0.0 111.751 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.64 131.63 45.53 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.261 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -75.34 117.76 17.49 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -57.25 -26.35 60.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.321 1.049 . . . . 0.0 112.09 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -77.7 80.26 4.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.782 0.833 . . . . 0.0 110.146 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.92 -179.95 1.63 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.955 1.302 . . . . 0.0 111.114 168.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.56 132.52 52.7 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.011 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -70.03 119.14 13.79 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -57.93 -24.75 59.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.269 1.428 . . . . 0.0 112.958 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.8 t90 -77.63 84.37 3.99 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -74.13 170.06 16.27 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.736 1.214 . . . . 0.0 112.066 -178.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -78.18 63.2 3.06 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.181 1.392 . . . . 0.0 109.45 173.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -72.39 134.4 45.41 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.95 -32.19 61.16 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.606 1.162 . . . . 0.0 112.589 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.1 m-90 -79.34 69.51 5.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.19 0.996 . . . . 0.0 110.499 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -67.82 175.54 2.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.778 1.231 . . . . 0.0 111.326 171.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -66.79 125.86 27.2 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.809 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -70.85 128.16 35.07 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.51 -25.85 67.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.017 0.927 . . . . 0.0 112.176 -177.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -78.49 76.53 4.99 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.985 0.914 . . . . 0.0 109.672 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.85 176.85 3.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.208 1.403 . . . . 0.0 111.688 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -76.83 74.29 3.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.448 1.099 . . . . 0.0 109.317 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -73.6 128.59 35.91 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -57.3 -30.57 64.84 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 112.26 -179.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 . . . . . 0 CA--C 1.538 0.492 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 . . . . . 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 . . . . . 0 CA--C 1.533 0.303 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 . . . . . 0 C--O 1.236 0.371 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 . . . . . 0 CA--C 1.535 0.397 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 . . . . . 0 C--O 1.236 0.352 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 . . . . . 0 CA--C 1.536 0.413 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? . . . . . 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 . . . . . 0 CA--C 1.533 0.306 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 . . . . . 0 C--O 1.236 0.362 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 112.295 0.48 . . . . 0.0 112.295 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 . . . . . 0 CA--C 1.534 0.33 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt . . . . . 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 . . . . . 0 CA--C 1.535 0.367 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 CA--C 1.535 0.379 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 . . . . . 0 CA--C 1.539 0.553 0 CA-C-O 122.396 1.093 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? . . . . . 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 . . . . . 0 CA--C 1.535 0.403 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 . . . . . 0 CA--C 1.535 0.368 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? . . . . . 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 112.187 0.439 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 . . . . . 0 C--O 1.236 0.353 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 . . . . . 0 CA--C 1.535 0.399 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 112.958 0.725 . . . . 0.0 112.958 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 . . . . . 0 CA--C 1.537 0.476 0 CA-C-O 122.299 1.047 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 . . . . . 0 CA--C 1.534 0.364 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 CA--C 1.535 0.373 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 . . . . . 0 CA--C 1.536 0.441 0 CA-C-O 121.639 0.733 . . . . 0.0 109.317 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.8 t70 . . . . . 0 N--CA 1.478 0.94 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 15.4 m-90 -144.33 126.98 16.1 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.918 1.287 . . . . 0.0 108.013 -179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -72.4 175.9 5.8 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.54 1.136 . . . . 0.0 111.106 168.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -70.04 134.14 47.95 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.526 176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.4 p-80 -65.31 160.36 21.88 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.597 0.759 . . . . 0.0 111.669 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.34 81.23 4.71 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.021 0.928 . . . . 0.0 108.78 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -54.07 134.32 58.9 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 124.393 1.077 . . . . 0.0 110.158 174.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_endo -73.49 160.92 43.52 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 124.486 3.457 . . . . 0.0 112.424 -174.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -76.61 123.24 25.81 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 173.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -58.11 -29.19 65.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.432 1.093 . . . . 0.0 112.164 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -67.26 -8.18 29.91 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.216 1.007 . . . . 0.0 113.468 -177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -55.18 -29.99 58.98 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 124.108 0.963 . . . . 0.0 111.561 167.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.9 m95 -93.91 -1.18 55.1 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.11 0.964 . . . . 0.0 113.26 -175.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 C--O 1.252 1.21 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 176.114 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -82.38 59.05 4.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.355 1.062 . . . . 0.0 110.945 -176.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.87 178.2 3.26 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.924 1.29 . . . . 0.0 111.459 174.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -64.15 136.83 57.59 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.212 178.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -64.4 163.77 12.61 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.733 0.813 . . . . 0.0 111.664 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.5 85.31 3.87 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -55.3 136.41 68.93 Favored Pre-proline 0 CA--C 1.542 0.664 0 C-N-CA 124.207 1.003 . . . . 0.0 109.368 174.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -71.33 157.46 56.77 Favored 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 124.517 3.478 . . . . 0.0 112.74 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -75.78 131.06 39.54 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 175.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -56.64 -33.08 65.98 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.422 1.089 . . . . 0.0 112.344 -176.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.64 -8.87 46.08 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.146 0.978 . . . . 0.0 113.416 -176.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -56.79 -29.89 63.13 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.977 0.911 . . . . 0.0 111.547 167.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -92.17 -5.39 52.7 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.565 0.746 . . . . 0.0 112.891 -172.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.252 1.223 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 178.304 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 68.3 t-105 -155.22 113.97 3.55 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.688 1.195 . . . . 0.0 108.056 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -81.71 -179.1 7.25 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 125.721 1.608 . . . . 0.0 111.195 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -71.65 110.35 6.15 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 167.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -69.58 161.14 30.18 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.225 0.61 . . . . 0.0 110.745 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.64 81.12 4.1 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.361 1.065 . . . . 0.0 109.047 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -54.3 135.78 60.42 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.455 1.102 . . . . 0.0 109.991 173.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.96 158.82 49.23 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 124.446 3.431 . . . . 0.0 112.836 -173.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 48.7 tptt -75.43 131.4 40.14 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t30 -55.94 -32.33 63.74 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.608 1.163 . . . . 0.0 112.35 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.9 m -68.32 -9.9 51.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.159 0.984 . . . . 0.0 113.371 -176.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -58.32 -28.11 64.75 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.849 0.86 . . . . 0.0 111.497 167.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.0 t-105 -89.04 -7.08 56.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.919 0.888 . . . . 0.0 112.735 -173.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 24.2 m . . . . . 0 C--O 1.252 1.233 0 C-N-CA 124.129 0.972 . . . . 0.0 108.509 179.153 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 33.8 t70 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -78.82 67.92 4.66 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.375 1.07 . . . . 0.0 110.699 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -68.59 176.56 2.87 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.213 170.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.95 111.07 5.39 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.425 178.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -63.26 151.93 39.17 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.261 1.024 . . . . 0.0 111.289 175.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.28 84.82 5.18 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 171.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -53.28 135.1 51.2 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.543 1.137 . . . . 0.0 110.343 178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.67 159.7 50.22 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 124.487 3.458 . . . . 0.0 112.488 -174.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -72.28 127.78 33.61 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.25 -33.14 62.9 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.674 1.189 . . . . 0.0 112.093 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.6 m -67.57 -9.97 47.68 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.162 0.985 . . . . 0.0 113.571 -174.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -56.0 -31.21 62.86 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.293 1.037 . . . . 0.0 111.694 167.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.8 t90 -100.46 -6.24 25.88 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.687 0.795 . . . . 0.0 112.829 -171.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.229 1.011 . . . . 0.0 108.541 178.29 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 73.6 t-105 -78.76 76.35 5.26 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.731 0.812 . . . . 0.0 109.514 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.81 174.8 6.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.82 1.248 . . . . 0.0 111.112 171.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -69.67 124.48 24.07 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.869 . . . . 0.0 109.449 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.15 160.24 21.69 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.98 0.912 . . . . 0.0 111.906 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.46 81.03 4.82 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.5 t60 -53.7 135.54 54.86 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 124.631 1.173 . . . . 0.0 110.42 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.62 160.41 44.13 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 124.474 3.449 . . . . 0.0 112.674 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -76.08 129.23 36.49 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 176.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 34.7 t30 -57.63 -26.1 61.1 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.591 1.156 . . . . 0.0 112.498 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 t -68.21 -10.47 54.63 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 112.522 -178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -58.1 -28.4 64.58 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.237 -0.914 . . . . 0.0 111.628 167.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 30.7 t-105 -91.31 -5.58 54.41 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.944 0.897 . . . . 0.0 112.769 -173.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.3 m . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.086 0.954 . . . . 0.0 108.586 177.967 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 31.6 t70 . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.036 -0.357 . . . . 0.0 110.036 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 67.8 t90 -79.82 94.98 5.9 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.84 170.61 5.17 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.393 1.077 . . . . 0.0 111.239 169.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -62.42 134.62 56.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.245 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -61.88 160.01 12.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.736 0.814 . . . . 0.0 112.166 -176.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.23 81.55 4.59 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.16 0.984 . . . . 0.0 108.668 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -52.78 135.38 46.13 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.459 1.104 . . . . 0.0 110.03 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.16 159.39 49.96 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 124.56 3.506 . . . . 0.0 112.608 -173.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -74.6 125.42 28.62 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 176.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.69 -23.6 59.76 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.568 1.147 . . . . 0.0 112.543 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -67.32 -12.62 60.63 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.546 0.738 . . . . 0.0 112.335 179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -58.31 -26.68 63.32 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.991 -1.068 . . . . 0.0 111.75 167.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.9 t-105 -88.83 -7.39 56.24 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.165 0.986 . . . . 0.0 112.707 -174.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.255 1.369 0 C-N-CA 124.165 0.986 . . . . 0.0 108.565 178.863 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 6.4 m-90 -80.55 61.35 4.24 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.486 1.114 . . . . 0.0 110.946 -177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -70.13 175.91 4.21 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.896 1.278 . . . . 0.0 111.377 173.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -70.47 112.85 7.06 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.947 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 34.7 p-80 -70.8 162.53 28.99 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.55 0.74 . . . . 0.0 110.679 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.81 83.35 3.4 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 124.439 1.095 . . . . 0.0 108.885 178.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.3 t60 -53.62 135.82 53.91 Favored Pre-proline 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 110.196 174.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.94 159.72 47.46 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.525 3.483 . . . . 0.0 112.828 -173.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.4 134.54 42.42 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 174.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -56.47 -28.54 59.98 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.597 1.159 . . . . 0.0 112.362 179.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.2 m -68.9 -3.26 12.0 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.234 1.014 . . . . 0.0 113.543 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.5 t80 -62.98 -29.57 70.92 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.037 -1.039 . . . . 0.0 111.307 165.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -101.73 -9.45 20.84 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.616 0.969 . . . . 0.0 113.616 -167.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.253 1.249 0 C-N-CA 123.766 0.826 . . . . 0.0 109.847 179.372 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 12.6 t0 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -141.28 41.39 1.77 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 124.621 1.168 . . . . 0.0 110.758 -172.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -64.2 172.01 2.69 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 122.119 0.961 . . . . 0.0 111.814 172.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -65.93 130.51 43.5 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.868 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -65.45 163.01 16.68 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.949 0.899 . . . . 0.0 111.929 -178.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.48 81.84 3.94 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 173.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -53.0 134.81 48.67 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 124.546 1.138 . . . . 0.0 110.2 174.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.53 159.06 49.89 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 124.415 3.41 . . . . 0.0 112.461 -174.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.0 tppt? -74.56 127.89 34.19 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -55.89 -31.52 62.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.616 1.166 . . . . 0.0 112.235 -179.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.7 m -67.69 -9.36 42.9 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.29 1.036 . . . . 0.0 113.41 -176.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -57.48 -29.34 64.18 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.923 0.889 . . . . 0.0 111.487 167.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 2.0 t-105 -90.15 -7.55 53.4 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.925 0.89 . . . . 0.0 112.702 -173.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.0 m . . . . . 0 C--O 1.253 1.271 0 C-N-CA 124.36 1.064 . . . . 0.0 108.597 179.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 75.0 t-105 -77.86 88.39 4.07 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -68.85 177.28 2.64 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.767 1.227 . . . . 0.0 111.005 168.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -66.52 114.89 5.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.273 178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -66.86 157.17 33.76 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.785 0.834 . . . . 0.0 111.732 -178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.17 82.96 6.12 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.8 t60 -52.64 134.91 45.11 Favored Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 124.245 1.018 . . . . 0.0 110.149 174.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.16 159.49 49.7 Favored 'Trans proline' 0 N--CA 1.458 -0.571 0 C-N-CA 124.397 3.398 . . . . 0.0 112.672 -174.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -73.3 128.81 36.55 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 175.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.6 t30 -56.68 -31.56 64.57 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.476 1.11 . . . . 0.0 112.298 -177.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -67.75 -8.93 39.54 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 113.434 -177.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -58.46 -27.83 64.75 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.78 0.832 . . . . 0.0 111.471 167.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -87.05 -9.38 55.62 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.892 0.877 . . . . 0.0 112.819 -175.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.5 m . . . . . 0 C--O 1.254 1.309 0 C-N-CA 124.1 0.96 . . . . 0.0 108.607 179.391 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.089 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 69.1 t-105 -79.67 70.73 6.23 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.991 0.916 . . . . 0.0 109.568 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.02 175.28 6.81 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.043 1.337 . . . . 0.0 111.421 174.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.8 t80 -68.19 129.92 41.37 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.662 178.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.07 155.23 24.62 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.239 1.016 . . . . 0.0 111.792 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 82.6 3.35 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.102 0.961 . . . . 0.0 108.732 174.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.5 t60 -54.18 136.19 59.13 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 124.856 1.263 . . . . 0.0 110.229 176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.77 160.03 47.13 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 124.512 3.475 . . . . 0.0 112.81 -173.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.62 131.26 40.78 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 174.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.29 -30.86 65.06 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.377 1.071 . . . . 0.0 112.295 -177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.3 m -68.01 -10.94 57.59 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.011 0.925 . . . . 0.0 113.409 -176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -58.97 -27.94 65.86 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.931 0.892 . . . . 0.0 111.52 168.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.8 t90 -95.38 -5.46 43.22 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.078 0.951 . . . . 0.0 112.607 -173.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 23.2 m . . . . . 0 C--O 1.252 1.236 0 C-N-CA 124.184 0.994 . . . . 0.0 108.561 177.418 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 . . . . . 0 N--CA 1.482 1.13 0 CA-C-O 122.435 1.112 . . . . 0.0 109.896 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -84.93 64.75 8.84 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.348 1.059 . . . . 0.0 110.62 -173.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -67.05 170.9 6.13 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 124.229 1.011 . . . . 0.0 111.619 172.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -69.92 121.46 17.39 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.625 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.45 159.5 24.17 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.951 0.901 . . . . 0.0 111.733 178.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.79 81.73 5.06 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -53.02 134.69 48.92 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.417 1.087 . . . . 0.0 110.317 175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.83 159.66 47.84 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 124.393 3.395 . . . . 0.0 112.516 -175.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -73.9 129.39 37.79 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 174.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -56.26 -30.36 62.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.651 1.18 . . . . 0.0 112.398 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.3 m -65.81 -14.54 61.58 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.877 0.871 . . . . 0.0 113.236 -177.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -59.9 -21.51 61.15 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.193 0.997 . . . . 0.0 111.927 170.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -80.63 -1.18 41.21 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.337 1.055 . . . . 0.0 112.475 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.5 t . . . . . 0 C--O 1.255 1.368 0 C-N-CA 124.942 1.297 . . . . 0.0 107.931 -171.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 18.9 p-10 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 122.266 1.032 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -83.63 77.58 9.83 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.032 0.933 . . . . 0.0 110.248 -174.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.27 175.49 3.26 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.096 0.958 . . . . 0.0 111.076 167.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -70.89 110.33 5.56 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.989 175.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -67.75 161.61 25.66 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.959 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.42 81.72 4.74 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.217 1.007 . . . . 0.0 108.672 175.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.0 t60 -53.5 135.78 52.85 Favored Pre-proline 0 CA--C 1.549 0.942 0 C-N-CA 124.383 1.073 . . . . 0.0 110.07 173.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.32 158.02 52.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 124.408 3.405 . . . . 0.0 112.732 -173.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -77.23 135.3 38.47 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -57.17 -28.09 62.5 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.385 1.074 . . . . 0.0 112.427 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.5 m -67.22 -10.72 53.39 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -61.14 -24.5 66.32 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.867 0.867 . . . . 0.0 111.637 169.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 42.1 m95 -88.92 -5.92 57.65 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.141 0.977 . . . . 0.0 112.57 -176.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 25.4 m . . . . . 0 C--O 1.252 1.225 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 177.872 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 34.6 t70 . . . . . 0 N--CA 1.479 0.996 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -79.0 64.46 3.93 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.671 1.188 . . . . 0.0 110.376 -178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.02 175.99 5.45 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 125.334 1.454 . . . . 0.0 112.083 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -77.37 61.73 2.25 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.855 1.662 . . . . 0.0 110.081 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -59.11 159.48 7.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.795 2.038 . . . . 0.0 111.339 176.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.87 82.54 4.24 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.122 1.369 . . . . 0.0 109.886 -175.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -52.61 137.2 43.02 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 124.68 1.192 . . . . 0.0 109.898 169.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -71.8 159.59 50.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.564 3.509 . . . . 0.0 113.064 -172.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -71.63 135.37 46.9 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.823 0.849 . . . . 0.0 108.995 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -54.54 -31.71 56.88 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.874 1.27 . . . . 0.0 112.352 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.5 m -68.55 -6.66 26.64 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.288 1.035 . . . . 0.0 113.526 -177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -58.31 -32.0 68.05 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.908 0.883 . . . . 0.0 111.45 165.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 t-105 -113.66 -12.09 12.87 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.326 0.862 . . . . 0.0 113.326 -167.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.253 1.254 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -173.5 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -79.18 69.84 5.45 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.27 1.028 . . . . 0.0 110.391 -178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.1 179.5 2.32 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.043 1.337 . . . . 0.0 111.369 172.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -63.62 134.13 54.92 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.446 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -62.94 160.59 14.53 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.907 0.883 . . . . 0.0 112.062 -177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.39 81.3 3.87 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.226 1.01 . . . . 0.0 108.72 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.8 t60 -53.76 135.78 55.26 Favored Pre-proline 0 CA--C 1.549 0.915 0 C-N-CA 124.613 1.165 . . . . 0.0 110.21 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.9 159.09 48.92 Favored 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 124.497 3.465 . . . . 0.0 112.659 -174.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -74.84 132.4 41.49 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -55.86 -30.23 61.16 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.626 1.171 . . . . 0.0 112.479 -178.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -66.41 -10.35 42.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.129 0.971 . . . . 0.0 113.35 -178.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -59.01 -25.08 63.36 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.351 -0.843 . . . . 0.0 111.728 169.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.3 m-90 -105.01 16.48 25.83 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.003 1.321 . . . . 0.0 112.125 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.253 1.239 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 175.115 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 74.5 t-105 -77.71 88.03 3.97 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -70.66 176.68 3.98 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 124.813 1.245 . . . . 0.0 111.211 171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -65.12 127.06 30.08 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.885 -179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 154.29 27.48 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.321 1.048 . . . . 0.0 111.841 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.43 83.71 3.85 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -53.24 135.08 50.78 Favored Pre-proline 0 CA--C 1.549 0.917 0 C-N-CA 124.721 1.208 . . . . 0.0 110.415 177.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.57 159.51 48.72 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 124.455 3.436 . . . . 0.0 112.536 -174.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.9 tppt? -74.92 128.33 35.31 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -57.86 -28.95 64.61 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.369 1.068 . . . . 0.0 112.187 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.0 m -67.66 -8.15 32.53 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 124.085 0.954 . . . . 0.0 113.386 -177.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -57.24 -28.74 63.18 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.937 0.895 . . . . 0.0 111.495 167.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -93.97 -2.5 53.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.142 0.977 . . . . 0.0 113.033 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 26.0 m . . . . . 0 C--O 1.253 1.243 0 N-CA-C 108.33 -0.989 . . . . 0.0 108.33 176.748 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -79.02 72.08 5.53 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.27 1.028 . . . . 0.0 110.256 -178.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -67.67 171.61 6.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.904 1.281 . . . . 0.0 111.751 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -68.64 131.63 45.53 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.261 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 p-80 -69.53 162.39 27.62 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.791 0.836 . . . . 0.0 111.326 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.45 82.15 4.74 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.191 0.996 . . . . 0.0 108.936 176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -53.62 134.44 54.71 Favored Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 124.55 1.14 . . . . 0.0 110.209 173.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -72.7 161.68 43.28 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.537 3.492 . . . . 0.0 112.019 -176.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -75.34 117.76 17.49 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 177.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -57.25 -26.35 60.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.321 1.049 . . . . 0.0 112.09 173.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.1 t -68.87 -9.69 52.87 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.421 0.688 . . . . 0.0 112.461 -178.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -57.63 -28.39 63.64 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.002 -1.061 . . . . 0.0 111.641 167.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.4 t90 -90.23 -5.8 55.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.918 0.887 . . . . 0.0 112.824 -174.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 27.1 m . . . . . 0 C--O 1.253 1.248 0 C-N-CA 124.011 0.924 . . . . 0.0 108.639 178.197 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 N--CA 1.479 1.006 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -77.7 80.26 4.16 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.782 0.833 . . . . 0.0 110.146 -178.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.92 -179.95 1.63 Allowed 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.955 1.302 . . . . 0.0 111.114 168.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.3 t80 -62.56 132.52 52.7 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.011 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.79 157.24 24.96 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.612 0.765 . . . . 0.0 112.16 -175.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.74 86.07 6.5 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 172.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.0 t60 -51.46 131.42 34.65 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 123.751 0.82 . . . . 0.0 109.738 173.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.03 159.98 51.25 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 124.165 3.243 . . . . 0.0 111.421 -177.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.4 tpmt? -70.03 119.14 13.79 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -57.93 -24.75 59.21 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.269 1.428 . . . . 0.0 112.958 179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.9 p -65.95 -11.28 46.33 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.234 1.014 . . . . 0.0 113.176 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.5 t80 -54.91 -28.23 49.14 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.028 0.931 . . . . 0.0 111.75 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -116.09 26.7 9.76 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.072 1.349 . . . . 0.0 111.202 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 t . . . . . 0 C--O 1.255 1.389 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 173.559 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 60.8 t90 -77.63 84.37 3.99 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -74.13 170.06 16.27 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.736 1.214 . . . . 0.0 112.066 -178.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.2 t80 -78.18 63.2 3.06 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.181 1.392 . . . . 0.0 109.45 173.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -53.83 151.88 6.03 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.035 2.134 . . . . 0.0 111.235 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.24 80.03 5.62 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.875 1.27 . . . . 0.0 110.159 -173.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.1 t60 -53.21 136.27 49.75 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.349 1.06 . . . . 0.0 109.799 169.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.37 158.29 51.73 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 124.468 3.446 . . . . 0.0 112.833 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -72.39 134.4 45.41 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 173.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -54.95 -32.19 61.16 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.606 1.162 . . . . 0.0 112.589 -176.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.4 m -66.84 -11.5 55.77 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 124.277 1.031 . . . . 0.0 113.426 -177.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.3 t80 -56.15 -28.77 59.29 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.904 0.882 . . . . 0.0 111.577 168.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 17.2 t-105 -99.53 12.5 36.28 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.554 1.142 . . . . 0.0 112.208 -174.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.254 1.301 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 176.448 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.094 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 7.1 m-90 -79.34 69.51 5.58 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.19 0.996 . . . . 0.0 110.499 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -67.82 175.54 2.97 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.778 1.231 . . . . 0.0 111.326 171.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -66.79 125.86 27.2 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.809 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -64.98 162.09 17.29 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.292 1.037 . . . . 0.0 111.944 -179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.44 82.0 3.9 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.7 t60 -52.91 135.85 47.09 Favored Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 124.587 1.155 . . . . 0.0 110.218 175.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -72.24 158.96 50.82 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 124.48 3.453 . . . . 0.0 112.632 -174.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -70.85 128.16 35.07 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 174.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -61.51 -25.85 67.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.017 0.927 . . . . 0.0 112.176 -177.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.0 m -67.16 -12.31 59.67 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.183 0.808 . . . . 0.0 113.183 -178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -62.77 -23.64 67.31 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.722 0.809 . . . . 0.0 111.519 169.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 32.1 t-105 -93.93 -8.57 39.75 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.171 0.988 . . . . 0.0 112.543 -175.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.254 1.331 0 C-N-CA 124.459 1.104 . . . . 0.0 108.555 178.886 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.481 1.104 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -78.49 76.53 4.99 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.985 0.914 . . . . 0.0 109.672 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -69.85 176.85 3.4 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.208 1.403 . . . . 0.0 111.688 176.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -76.83 74.29 3.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.448 1.099 . . . . 0.0 109.317 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -61.4 159.62 12.33 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.845 1.258 . . . . 0.0 110.867 177.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.06 81.76 4.43 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.701 1.2 . . . . 0.0 109.489 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.0 t60 -52.9 135.62 47.2 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.579 1.152 . . . . 0.0 109.961 171.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.06 158.46 52.27 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.362 3.375 . . . . 0.0 112.485 -174.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -73.6 128.59 35.91 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 175.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 30.0 t30 -57.3 -30.57 64.84 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 112.26 -179.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.1 m -67.21 -13.91 62.41 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.015 0.926 . . . . 0.0 113.089 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -57.64 -25.26 59.91 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.939 0.895 . . . . 0.0 111.639 169.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 6.6 t-105 -84.11 0.94 46.45 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.181 0.993 . . . . 0.0 112.632 -176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.255 13.6 t . . . . . 0 C--O 1.254 1.307 0 CA-C-O 116.736 -1.602 . . . . 0.0 107.218 -174.233 . . . . . . . . 1 1 . 1 stop_ save_